G4LUD9_SCHMA Loading...

Myosin regulatory light chain, putative

AlphaFold DB , UniProt , Accession G4LUD9, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 200 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	61.7	Low	67.1	Low	216 Å²	216	147.9 Å²	147.9	100%	1.064	71%	0.705	S	S	*	*				0	-21.3	0	-89.2	-171.7	-89.7	0	0	114.8
2	G	61.2	Low	67.4	Low	63 Å²	63	147.4 Å²	147.4	65%	0.649	70%	0.698	S	S	*	*			trans	-81.1	-33.5	177.9	0	0	0	0	0	115.5
3	E	62.7	Low	67.2	Low	174 Å²	174	145.4 Å²	145.4	81%	0.813	69%	0.688	S	S	*	*	H	α-helix	trans	-73.6	-37.3	-173.4	-64.4	-176.7	129.7	0	0	113.1	K5 K6 E7	E3-K5 VanDerWaalsContact C-N 3.3Å; E3-K5 PolarHBondContact O-N 2.66Å; E3-K6 WeakPolarHBondContact O-CB 3.45Å; E3-K6 PolarHBondContact O-N 3.04Å; E3-E7 PolarHBondContact O-N 3.31Å; E3-E7 VanDerWaalsContact O-N 3.16Å
4	E	62.6	Low	66.7	Low	141 Å²	141	147.4 Å²	147.4	66%	0.659	69%	0.692	S	S	*	*	H	α-helix	trans	-65.4	-30.6	-178.8	-143.2	-178.6	153.2	0	0	113.2	K8	E4-K8 PolarHBondContact O-N 3.01Å
5	K	69.4	Low	66.3	Low	175 Å²	175	146.1 Å²	146.1	76%	0.761	68%	0.684	S	S	*	*	H	α-helix	trans	-71.9	-30.7	173.6	-80.1	-170.3	175.7	-176.6	0	112.4	E3 K9	E3-K5 VanDerWaalsContact C-N 3.3Å; E3-K5 PolarHBondContact O-N 2.66Å; K5-K9 PolarHBondContact O-N 3.16Å
6	K	71.7	Confident	65.5	Low	150 Å²	150	144.1 Å²	144.1	65%	0.652	67%	0.674	S	S	*	*	H	α-helix	trans	-73.1	-41.7	178.6	-165.1	179.6	176	-171.8	0	110.7	E3 K8 K9 E10	E3-K6 WeakPolarHBondContact O-CB 3.45Å; E3-K6 PolarHBondContact O-N 3.04Å; K6-K8 PolarHBondContact O-N 3.46Å; K6-K9 PolarHBondContact O-N 3.38Å; K6-K9 VanDerWaalsContact O-N 3.15Å; K6-E10 PolarHBondContact O-N 3.46Å; K6-E10 VanDerWaalsContact O-N 3.09Å
7	E	69.9	Low	64.8	Low	122 Å²	122	143.8 Å²	143.8	57%	0.57	67%	0.67	S	S	*	*	H	α-helix	trans	-64.8	-39.4	178.2	-158.6	-172.9	148.2	0	0	112.6	E3 K9 E10 K11	E3-E7 PolarHBondContact O-N 3.31Å; E3-E7 VanDerWaalsContact O-N 3.16Å; E7-K9 VanDerWaalsContact C-N 3.29Å; E7-K9 PolarHBondContact O-N 3.29Å; E7-E10 PolarHBondContact O-N 3.02Å; E7-K11 PolarHBondContact O-N 3.4Å
8	K	70.6	Confident	64	Low	164 Å²	164	142.4 Å²	142.4	71%	0.713	66%	0.661	S	S	*	*	H	α-helix	trans	-62.1	-34.2	173.4	-94.5	-175.6	174.6	176.4	0	113.1	E4 K6 K12	E4-K8 PolarHBondContact O-N 3.01Å; K6-K8 PolarHBondContact O-N 3.46Å; K8-K12 PolarHBondContact O-N 3.47Å
9	K	73.8	Confident	63.3	Low	145 Å²	145	141.1 Å²	141.1	63%	0.63	66%	0.655	S	S	*	*	H	α-helix	trans	-72.2	-43.7	178.2	-167.9	-179.9	174.8	-172.6	0	111.3	K5 K6 E7 K11 K12 E13	K5-K9 PolarHBondContact O-N 3.16Å; K6-K9 PolarHBondContact O-N 3.38Å; K6-K9 VanDerWaalsContact O-N 3.15Å; E7-K9 VanDerWaalsContact C-N 3.29Å; E7-K9 PolarHBondContact O-N 3.29Å; K9-K11 PolarHBondContact O-N 3.11Å; K9-K12 PolarHBondContact O-N 3.4Å; K9-E13 PolarHBondContact O-N 3.03Å; K9-E13 VanDerWaalsContact O-N 3.11Å
10	E	68	Low	62.5	Low	127 Å²	127	143.2 Å²	143.2	59%	0.593	66%	0.662	S	S	*	*	H	α-helix	trans	-63.2	-39	176.2	-105.5	179.6	106.2	0	0	112.7	K6 E7 K12 E13 K14	K6-E10 PolarHBondContact O-N 3.46Å; K6-E10 VanDerWaalsContact O-N 3.09Å; E7-E10 PolarHBondContact O-N 3.02Å; E10-K12 VanDerWaalsContact C-N 3.3Å; E10-K12 PolarHBondContact O-N 3.41Å; E10-E13 PolarHBondContact O-N 3.29Å; E10-K14 WeakPolarHBondContact O-CB 3.43Å; E10-K14 PolarHBondContact O-N 3.09Å
11	K	66.9	Low	61.4	Low	150 Å²	150	142.7 Å²	142.7	65%	0.652	66%	0.661	S	S	*	*	H	α-helix	trans	-63.2	-35	174.7	-108.4	176.5	177.3	165.4	0	112.8	E7 K9 K15	E7-K11 PolarHBondContact O-N 3.4Å; K9-K11 PolarHBondContact O-N 3.11Å; K11-K15 PolarHBondContact O-N 3.18Å
12	K	69.8	Low	60.4	Low	142 Å²	142	139.2 Å²	139.2	62%	0.617	64%	0.641	S	S	*	*	H	α-helix	trans	-70.8	-45.9	178.1	-167.8	-179.2	175.2	-172.8	0	111.5	K8 K9 E10 K14 K15 E16	K8-K12 PolarHBondContact O-N 3.47Å; K9-K12 PolarHBondContact O-N 3.4Å; E10-K12 VanDerWaalsContact C-N 3.3Å; E10-K12 PolarHBondContact O-N 3.41Å; K12-K14 VanDerWaalsContact C-N 3.32Å; K12-K14 PolarHBondContact O-N 3.4Å; K12-K15 PolarHBondContact O-N 3.15Å; K12-E16 PolarHBondContact O-N 3.31Å
13	E	64.9	Low	59.4	Low	121 Å²	121	143.6 Å²	143.6	57%	0.565	65%	0.65	S	S	*	*	H	α-helix	trans	-63.7	-36.3	177.1	-84.7	-179.7	107.5	0	0	112.4	K9 E10 K15 E16 K17	K9-E13 PolarHBondContact O-N 3.03Å; K9-E13 VanDerWaalsContact O-N 3.11Å; E10-E13 PolarHBondContact O-N 3.29Å; E13-K15 VanDerWaalsContact C-N 3.33Å; E13-K15 PolarHBondContact O-N 3.19Å; E13-E16 PolarHBondContact O-N 3.07Å; E13-K17 WeakPolarHBondContact O-CB 3.49Å; E13-K17 PolarHBondContact O-N 3.25Å
14	K	60.6	Low	58.1	Low	173 Å²	173	139.5 Å²	139.5	75%	0.752	65%	0.646	S	S	*	*	H	α-helix	trans	-70.4	-29	177.5	-148.6	174	-174.7	178.8	0	112.7	E10 K12 K18	E10-K14 WeakPolarHBondContact O-CB 3.43Å; E10-K14 PolarHBondContact O-N 3.09Å; K12-K14 VanDerWaalsContact C-N 3.32Å; K12-K14 PolarHBondContact O-N 3.4Å; K14-K18 PolarHBondContact O-N 3.05Å
15	K	60.9	Low	56.5	Low	129 Å²	129	136.5 Å²	136.5	56%	0.561	65%	0.653	S	S	*	*	H	α-helix	trans	-74.2	-44.5	174.1	-162.5	179.7	-173	-91.2	0	111.6	K11 K12 E13 K17 K18 E19	K11-K15 PolarHBondContact O-N 3.18Å; K12-K15 PolarHBondContact O-N 3.15Å; E13-K15 VanDerWaalsContact C-N 3.33Å; E13-K15 PolarHBondContact O-N 3.19Å; K15-K17 VanDerWaalsContact C-N 3.28Å; K15-K17 PolarHBondContact O-N 3.24Å; K15-K18 PolarHBondContact O-N 3.5Å; K15-E19 IonicContact NZ-OE1 2.64Å; K15-E19 PolarHBondContact NZ-OE1 3.05Å; K15-E19 PolarHBondContact O-N 3.36Å; K15-E19 VanDerWaalsContact O-N 3.07Å
16	E	53.2	Low	54.9	Low	113 Å²	113	132.9 Å²	132.9	53%	0.528	66%	0.656	S	S	.	*	H	α-helix	trans	-64.4	-31.1	176.9	-83.3	178.2	127.6	0	0	112.8	K12 E13 K20	K12-E16 PolarHBondContact O-N 3.31Å; E13-E16 PolarHBondContact O-N 3.07Å; E16-K20 PolarHBondContact O-N 3.4Å
17	K	53.5	Low	53.2	Low	140 Å²	140	131.5 Å²	131.5	61%	0.609	66%	0.662	S	S	*	*	H	α-helix	trans	-76.2	-34.3	175.9	-156	177.5	-179.9	-171.5	0	112.8	E13 K15 K20 E21	E13-K17 WeakPolarHBondContact O-CB 3.49Å; E13-K17 PolarHBondContact O-N 3.25Å; K15-K17 VanDerWaalsContact C-N 3.28Å; K15-K17 PolarHBondContact O-N 3.24Å; K17-K20 PolarHBondContact O-N 2.7Å; K17-E21 PolarHBondContact O-N 3.43Å
18	K	50.8	Low	51.7	Low	118 Å²	118	130.8 Å²	130.8	51%	0.513	68%	0.677	S	S	.	*	H	α-helix	trans	-71.9	-37.1	178.1	-166.1	175.2	-173.8	-71.3	0	112.1	K14 K15 K20 E21 E22	K14-K18 PolarHBondContact O-N 3.05Å; K15-K18 PolarHBondContact O-N 3.5Å; K18-K20 VanDerWaalsContact C-N 3.27Å; K18-K20 PolarHBondContact O-N 3.47Å; K18-E21 PolarHBondContact O-N 3.41Å; K18-E22 IonicContact NZ-OE1 2.66Å; K18-E22 PolarHBondContact NZ-OE1 3.39Å; K18-E22 IonicContact NZ-OE2 3.01Å; K18-E22 PolarHBondContact NZ-OE2 3.4Å; K18-E22 PolarHBondContact O-N 3.36Å
19	E	50.2	Low	49.6	Very low	117 Å²	117	131.4 Å²	131.4	55%	0.547	68%	0.682	S	S	.	*	H	α-helix	trans	-70.4	-21.5	175.7	-72.8	174.3	-179.9	0	0	112.9	K15	K15-E19 IonicContact NZ-OE1 2.64Å; K15-E19 PolarHBondContact NZ-OE1 3.05Å; K15-E19 PolarHBondContact O-N 3.36Å; K15-E19 VanDerWaalsContact O-N 3.07Å
20	K	46.6	Very low	47.7	Very low	183 Å²	183	132.1 Å²	132.1	80%	0.796	69%	0.693	S	S	*	*	H	α-helix	trans	-84.8	-17.8	174.3	-94	-174	174.7	-178.7	0	115	E16 K17 K18	E16-K20 PolarHBondContact O-N 3.4Å; K17-K20 PolarHBondContact O-N 2.7Å; K18-K20 VanDerWaalsContact C-N 3.27Å; K18-K20 PolarHBondContact O-N 3.47Å
21	E	40.9	Very low	46	Very low	134 Å²	134	134.5 Å²	134.5	63%	0.626	70%	0.701	S	S	*	*	H	α-helix	trans	-99.6	-15.8	-178.8	-78.3	-179.6	178	0	0	113.2	K17 K18	K17-E21 PolarHBondContact O-N 3.43Å; K18-E21 PolarHBondContact O-N 3.41Å
22	E	39.6	Very low	44	Very low	142 Å²	142	135.5 Å²	135.5	66%	0.664	71%	0.706	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.5	1.8	-179.1	-77.3	-179.5	160.2	0	0	114.9	K18	K18-E22 IonicContact NZ-OE1 2.66Å; K18-E22 PolarHBondContact NZ-OE1 3.39Å; K18-E22 IonicContact NZ-OE2 3.01Å; K18-E22 PolarHBondContact NZ-OE2 3.4Å; K18-E22 PolarHBondContact O-N 3.36Å
23	D	41.6	Very low	42.2	Very low	156 Å²	156	136.1 Å²	136.1	83%	0.834	71%	0.711	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.4	15.1	174	-164	54.1	0	0	0	113.6
24	A	35.5	Very low	40.2	Very low	88 Å²	88	136.2 Å²	136.2	73%	0.727	72%	0.72	S	S	*	*			trans	-120.6	82.7	179.7	0	0	0	0	0	111.4
25	G	29.1	Very low	38.8	Very low	77 Å²	77	132.9 Å²	132.9	79%	0.794	73%	0.725	S	S	*	*			trans	150	111.5	154.1	0	0	0	0	0	116.4
26	A	35.5	Very low	37.4	Very low	100 Å²	100	132.2 Å²	132.2	83%	0.826	74%	0.736	S	S	*	*				-162.1	135.2	102.6	0	0	0	0	0	109.7
27	P	35.5	Very low	36.2	Very low	121 Å²	121	132.6 Å²	132.6	79%	0.786	75%	0.751	S	S	*	*			trans	-86.5	132.1	-177.7	33.7	-29.6	0	0	0	110.5	E29	P27-E29 PolarHBondContact O-N 3.44Å
28	A	38.7	Very low	35	Very low	106 Å²	106	129.7 Å²	129.7	88%	0.876	76%	0.761	S	S	*	*			trans	-82.3	107.5	164.1	0	0	0	0	0	108.5
29	E	26.4	Very low	33.7	Very low	177 Å²	177	128 Å²	128	83%	0.827	78%	0.777	S	S	*	*			trans	-62.5	127	160.5	-62	-179.8	127.7	0	0	108.8	P27	P27-E29 PolarHBondContact O-N 3.44Å
30	D	34.5	Very low	32.6	Very low	161 Å²	161	126.7 Å²	126.7	86%	0.861	80%	0.795	S	S	*	*			trans	-148.5	151.2	140.3	-121	-39.3	0	0	0	114
31	K	31.1	Very low	31.7	Very low	177 Å²	177	121.2 Å²	121.2	77%	0.77	79%	0.791	S	S	*	*			trans	-88.6	142.2	-151.5	-82.1	165.4	175.3	163.6	0	113.3
32	K	25.8	Very low	31.4	Very low	171 Å²	171	118.8 Å²	118.8	74%	0.743	80%	0.801	S	S	*	*				67.4	120.4	121.7	-157	-162.5	-174.3	-152.1	0	118.2
33	E	30.6	Very low	31.5	Very low	155 Å²	155	115.3 Å²	115.3	72%	0.724	80%	0.804	S	S	*	*				157.4	95.5	125.7	-83.6	-175.8	171.7	0	0	109.1
34	T	24.2	Very low	31.5	Very low	123 Å²	123	117.8 Å²	117.8	76%	0.755	81%	0.807	S	S	*	*				68.4	110.4	96.3	56.7	0	0	0	0	116.5
35	A	30.1	Very low	31.7	Very low	103 Å²	103	122.9 Å²	122.9	85%	0.851	81%	0.807	S	S	*	*			trans	92	135.6	135.7	0	0	0	0	0	120.8
36	S	33.1	Very low	32.7	Very low	114 Å²	114	123.9 Å²	123.9	80%	0.797	81%	0.808	S	S	*	*			trans	89.4	92	166.7	-156.2	0	0	0	0	115.4
37	S	27.9	Very low	33.1	Very low	121 Å²	121	127.4 Å²	127.4	85%	0.846	81%	0.808	S	S	*	*				74.2	105.6	83.3	176.2	0	0	0	0	114.2
38	G	27	Very low	33.6	Very low	79 Å²	79	130.6 Å²	130.6	81%	0.814	80%	0.804	S	S	*	*			trans	117.6	129.5	144.5	0	0	0	0	0	116.8
39	G	25	Very low	34.4	Very low	82 Å²	82	128.8 Å²	128.8	85%	0.845	79%	0.789	S	S	*	*			trans	109	111	150.6	0	0	0	0	0	115.3
40	G	25.9	Very low	35.8	Very low	90 Å²	90	123.1 Å²	123.1	93%	0.928	77%	0.766	S	S	*	*			trans	-64.6	143.7	179.2	0	0	0	0	0	114.3
41	G	29	Very low	37	Very low	69 Å²	69	119.7 Å²	119.7	71%	0.711	76%	0.755	S	S	*	*			trans	-156.7	84.6	163.9	0	0	0	0	0	106.1	G43	G41-G43 VanDerWaalsContact C-N 3.35Å; G41-G43 PolarHBondContact O-N 3.22Å
42	G	33.9	Very low	38.9	Very low	82 Å²	82	117.4 Å²	117.4	85%	0.845	75%	0.752	S	S	*	*			trans	-54.9	103.9	172.2	0	0	0	0	0	107.8	K44	G42-K44 PolarHBondContact O-N 2.9Å; G42-K44 VanDerWaalsContact O-N 3.11Å
43	G	40.7	Very low	41.2	Very low	69 Å²	69	109.4 Å²	109.4	71%	0.711	72%	0.717	S	S	*	*			trans	-50	121.6	-178.2	0	0	0	0	0	108.4	G41 R45	G41-G43 VanDerWaalsContact C-N 3.35Å; G41-G43 PolarHBondContact O-N 3.22Å; G43-R45 PolarHBondContact O-N 2.79Å
44	K	41.4	Very low	43.5	Very low	209 Å²	209	106.2 Å²	106.2	91%	0.909	70%	0.701	S	S	*	*			trans	-46.1	111.8	170.7	-76	170.8	179.4	163.5	0	106.4	G42 A46	G42-K44 PolarHBondContact O-N 2.9Å; G42-K44 VanDerWaalsContact O-N 3.11Å; K44-A46 VanDerWaalsContact C-N 3.29Å; K44-A46 PolarHBondContact O-N 2.88Å
45	R	40	Very low	46.1	Very low	194 Å²	194	103.8 Å²	103.8	73%	0.732	70%	0.7	S	S	*	*			trans	-53.5	98.3	175.1	-161.1	175.8	-179.4	-169.2	1.4	105.4	G43 Q47	G43-R45 PolarHBondContact O-N 2.79Å; R45-Q47 VanDerWaalsContact C-N 3.29Å; R45-Q47 WeakPolarHBondContact O-CA 3.12Å; R45-Q47 PolarHBondContact O-N 3.03Å
46	A	49.7	Very low	48.2	Very low	99 Å²	99	103.5 Å²	103.5	82%	0.818	68%	0.682	S	S	*	*			trans	-55	104	173.3	0	0	0	0	0	105.6	K44 R48	K44-A46 VanDerWaalsContact C-N 3.29Å; K44-A46 PolarHBondContact O-N 2.88Å; A46-R48 PolarHBondContact O-N 3.02Å
47	Q	43.9	Very low	50.4	Low	173 Å²	173	98.7 Å²	98.7	81%	0.808	65%	0.647	S	S	*	*			trans	-78.6	90.9	-154.3	178.6	180	-79.8	0	0	108	R45 A49	R45-Q47 VanDerWaalsContact C-N 3.29Å; R45-Q47 WeakPolarHBondContact O-CA 3.12Å; R45-Q47 PolarHBondContact O-N 3.03Å; Q47-A49 PolarHBondContact O-N 2.71Å
48	R	47.5	Very low	53	Low	189 Å²	189	96 Å²	96	71%	0.713	63%	0.627	S	S	*	*	S	Bend	trans	36.6	14.7	148.5	-72.1	-177	171	-179.8	-5.4	120.3	A46 T50 S51	A46-R48 PolarHBondContact O-N 3.02Å; R48-T50 VanDerWaalsContact C-N 3.27Å; R48-T50 PolarHBondContact O-N 2.95Å; R48-S51 PolarHBondContact O-N 3.42Å
49	A	54	Low	55.7	Low	68 Å²	68	98.9 Å²	98.9	56%	0.562	62%	0.619	S	S	*	*	G	3₁₀ helix	trans	-71.7	-26.3	-174.5	0	0	0	0	0	111.6	Q47 S51	Q47-A49 PolarHBondContact O-N 2.71Å; A49-S51 PolarHBondContact O-N 3.24Å
50	T	56.6	Low	58.6	Low	57 Å²	57	99.6 Å²	99.6	35%	0.35	60%	0.604	S	S	.	*	G	3₁₀ helix	trans	-68.1	-21.6	176.1	58.5	0	0	0	0	113.6	R48 N52 V53 T115 M116 N119	R48-T50 VanDerWaalsContact C-N 3.27Å; R48-T50 PolarHBondContact O-N 2.95Å; T50-N52 VanDerWaalsContact C-N 3.26Å; T50-N52 PolarHBondContact O-N 2.96Å; T50-N52 VanDerWaalsContact O-N 3.08Å; T50-V53 PolarHBondContact O-N 2.96Å; T50-T115 HydrophobicContact CG2-CG2 3.98Å; T50-M116 HydrophobicContact CG2-CE 3.53Å; T50-M116 HydrophobicContact CG2-SD 4.24Å; T50-N119 VanDerWaalsContact CG2-ND2 3.31Å; T50-N119 WeakPolarHBondContact CG2-ND2 3.4Å
51	S	59.1	Low	61.3	Low	89 Å²	89	98.8 Å²	98.8	62%	0.622	58%	0.575	S	S	*	*	G	3₁₀ helix	trans	-67.8	-22.4	-155.8	-164.2	0	0	0	0	114.7	R48 A49	R48-S51 PolarHBondContact O-N 3.42Å; A49-S51 PolarHBondContact O-N 3.24Å
52	N	71.9	Confident	64.2	Low	130 Å²	130	96.3 Å²	96.3	70%	0.695	55%	0.546	S	S	*	.	G	3₁₀ helix	trans	-128.3	10.7	-178.2	-81.5	8.7	0	0	0	114	T50 F54 G55	T50-N52 VanDerWaalsContact C-N 3.26Å; T50-N52 PolarHBondContact O-N 2.96Å; T50-N52 VanDerWaalsContact O-N 3.08Å; N52-F54 VanDerWaalsContact C-N 3.26Å; N52-F54 PolarHBondContact O-N 3.4Å; N52-G55 WeakPolarHBondContact O-CA 3.43Å; N52-G55 PolarHBondContact O-N 3.37Å
53	V	74.7	Confident	66.8	Low	3 Å²	3	96.3 Å²	96.3	2%	0.018	52%	0.524	C	S	.	.	G	3₁₀ helix	trans	-61.4	-36.5	-173.6	75	0	0	0	0	112.8	T50 G55 M56 F57 T115 I118 N119	T50-V53 PolarHBondContact O-N 2.96Å; V53-G55 PolarHBondContact O-N 2.79Å; V53-M56 HydrophobicContact CG2-SD 4.06Å; V53-M56 VanDerWaalsContact O-CB 3.32Å; V53-M56 WeakPolarHBondContact O-CB 3.37Å; V53-M56 PolarHBondContact O-N 2.93Å; V53-F57 HydrophobicContact CG2-CE2 4.41Å; V53-T115 HydrophobicContact CG1-CG2 4.26Å; V53-I118 HydrophobicContact CB-CG2 4.43Å; V53-I118 HydrophobicContact CG1-CG2 4.08Å; V53-I118 HydrophobicContact CG2-CB 4.47Å; V53-I118 HydrophobicContact CG2-CG2 3.61Å; V53-N119 WeakPolarHBondContact CB-OD1 3.31Å; V53-N119 VanDerWaalsContact CG1-OD1 3.25Å; V53-N119 WeakPolarHBondContact CG1-OD1 3.27Å; V53-N119 WeakPolarHBondContact CG2-OD1 3.36Å
54	F	77.6	Confident	69.2	Low	87 Å²	87	98.4 Å²	98.4	38%	0.382	52%	0.515	S	S	.	.	G	3₁₀ helix	trans	-64.2	-20.6	174.8	-65.3	-78.8	0	0	0	113.4	N52 M56 I62 F114 T115 I118	N52-F54 VanDerWaalsContact C-N 3.26Å; N52-F54 PolarHBondContact O-N 3.4Å; F54-M56 VanDerWaalsContact C-N 3.34Å; F54-I62 HydrophobicContact CD1-CD1 4.46Å; F54-I62 HydrophobicContact CD1-CG2 4.4Å; F54-I62 WeakPolarHBondContact O-CD1 3.43Å; F54-F114 HydrophobicContact CE1-CD1 4.31Å; F54-F114 AromaticContact CE1-CE1 3.96Å; F54-F114 HydrophobicContact CE1-CE1 3.96Å; F54-F114 HydrophobicContact CZ-CD1 4.46Å; F54-T115 HydrophobicContact CE2-CG2 4.04Å; F54-T115 HydrophobicContact CZ-CG2 4.43Å; F54-I118 HydrophobicContact CD1-CD1 3.95Å; F54-I118 HydrophobicContact CE1-CD1 3.46Å; F54-I118 VanDerWaalsContact CE1-CD1 3.46Å; F54-I118 HydrophobicContact CZ-CD1 4.21Å
55	G	78.9	Confident	71.6	Confident	72 Å²	72	89.5 Å²	89.5	74%	0.742	48%	0.477	S	S	*	.	G	3₁₀ helix	trans	-81.7	-12.5	173.7	0	0	0	0	0	113.7	N52 V53	N52-G55 WeakPolarHBondContact O-CA 3.43Å; N52-G55 PolarHBondContact O-N 3.37Å; V53-G55 PolarHBondContact O-N 2.79Å
56	M	74.8	Confident	74.1	Confident	97 Å²	97	85.7 Å²	85.7	48%	0.478	47%	0.465	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.1	-22.9	-178.4	-57.1	178.5	81.1	0	0	112.4	V53 F54 N126	V53-M56 HydrophobicContact CG2-SD 4.06Å; V53-M56 VanDerWaalsContact O-CB 3.32Å; V53-M56 WeakPolarHBondContact O-CB 3.37Å; V53-M56 PolarHBondContact O-N 2.93Å; F54-M56 VanDerWaalsContact C-N 3.34Å; M56-N126 HydrophobicContact CE-CB 3.71Å; M56-N126 WeakPolarHBondContact CE-ND2 3.37Å
57	F	80.2	Confident	76.3	Confident	13 Å²	13	86.1 Å²	86.1	6%	0.057	45%	0.45	C	S	.	.	S	Bend	trans	-116.8	141	-173.1	-64	-69.5	0	0	0	111.6	V53 Q61 I62 F65 I118 G122 L125	V53-F57 HydrophobicContact CG2-CE2 4.41Å; F57-Q61 HydrophobicContact CB-CB 4.37Å; F57-Q61 VanDerWaalsContact CD1-OE1 3.29Å; F57-I62 HydrophobicContact CB-CD1 4.49Å; F57-I62 HydrophobicContact CB-CG1 3.87Å; F57-F65 AromaticContact CD1-CE2 3.93Å; F57-F65 HydrophobicContact CD1-CE2 3.93Å; F57-F65 HydrophobicContact CD2-CE2 4.22Å; F57-F65 AromaticContact CE1-CE2 3.97Å; F57-F65 HydrophobicContact CE1-CE2 3.97Å; F57-F65 HydrophobicContact CE1-CZ 4.16Å; F57-F65 HydrophobicContact CE2-CE2 4.27Å; F57-F65 HydrophobicContact CG-CE2 4.01Å; F57-F65 HydrophobicContact CZ-CE2 4.09Å; F57-F65 HydrophobicContact CZ-CZ 4.25Å; F57-I118 HydrophobicContact CD2-CG2 3.66Å; F57-I118 HydrophobicContact CE2-CG2 3.56Å; F57-G122 VanDerWaalsContact CZ-CA 3.46Å; F57-L125 HydrophobicContact CE1-CB 4.38Å; F57-L125 HydrophobicContact CE1-CD1 4.08Å; F57-L125 HydrophobicContact CZ-CD1 4.35Å
58	P	82	Confident	78.6	Confident	64 Å²	64	79.7 Å²	79.7	42%	0.416	43%	0.427	S	S	.	.			trans	-66.8	153.8	171.7	32.6	-36.9	0	0	0	110.5	N60 Q61 I62	P58-N60 VanDerWaalsContact CB-OD1 3.3Å; P58-N60 WeakPolarHBondContact CB-OD1 3.43Å; P58-N60 WeakPolarHBondContact CG-OD1 3.48Å; P58-N60 PolarHBondContact O-N 3.43Å; P58-N60 VanDerWaalsContact O-N 3.09Å; P58-Q61 HydrophobicContact CG-CB 4.03Å; P58-Q61 HydrophobicContact CG-CG 3.82Å; P58-Q61 PolarHBondContact O-N 2.91Å; P58-I62 PolarHBondContact O-N 3.12Å; P58-I62 VanDerWaalsContact O-N 3.11Å
59	Q	84.1	Confident	80.9	Confident	141 Å²	141	71.2 Å²	71.2	66%	0.659	40%	0.395	S	S	*	.	H	α-helix	trans	-57.5	-32	-171.9	-170.6	63.4	26.6	0	0	113.9	I62 Q63	Q59-I62 PolarHBondContact O-N 3.03Å; Q59-Q63 PolarHBondContact O-N 3.36Å
60	N	84.5	Confident	82.8	Confident	97 Å²	97	71.3 Å²	71.3	52%	0.519	39%	0.391	S	S	.	.	H	α-helix	trans	-67.2	-40.2	176.1	63.1	-60.1	0	0	0	112.1	P58 Q63 E64	P58-N60 VanDerWaalsContact CB-OD1 3.3Å; P58-N60 WeakPolarHBondContact CB-OD1 3.43Å; P58-N60 WeakPolarHBondContact CG-OD1 3.48Å; P58-N60 PolarHBondContact O-N 3.43Å; P58-N60 VanDerWaalsContact O-N 3.09Å; N60-Q63 WeakPolarHBondContact O-CB 3.4Å; N60-Q63 PolarHBondContact O-N 2.86Å; N60-E64 WeakPolarHBondContact O-CG 3.46Å; N60-E64 PolarHBondContact O-N 3.47Å
61	Q	83.4	Confident	84.6	Confident	72 Å²	72	74.8 Å²	74.8	34%	0.336	41%	0.407	S	S	.	.	H	α-helix	trans	-68.2	-38.6	174.9	-75.1	-175.1	-3.6	0	0	111.5	F57 P58 Q63 E64 F65	F57-Q61 HydrophobicContact CB-CB 4.37Å; F57-Q61 VanDerWaalsContact CD1-OE1 3.29Å; P58-Q61 HydrophobicContact CG-CB 4.03Å; P58-Q61 HydrophobicContact CG-CG 3.82Å; P58-Q61 PolarHBondContact O-N 2.91Å; Q61-Q63 PolarHBondContact O-N 2.88Å; Q61-E64 PolarHBondContact O-N 3.23Å; Q61-F65 HydrophobicContact CB-CE2 4.16Å; Q61-F65 WeakPolarHBondContact O-CD2 3.44Å; Q61-F65 WeakPolarHBondContact O-CG 3.4Å; Q61-F65 PolarHBondContact O-N 2.88Å
62	I	88.7	Confident	86.4	Confident	17 Å²	17	71.6 Å²	71.6	9%	0.087	38%	0.383	C	S	.	.	H	α-helix	trans	-58.4	-39.3	173.3	-61.3	173.7	0	0	0	110.8	F54 F57 P58 Q59 F65 K66	F54-I62 HydrophobicContact CD1-CD1 4.46Å; F54-I62 HydrophobicContact CD1-CG2 4.4Å; F54-I62 WeakPolarHBondContact O-CD1 3.43Å; F57-I62 HydrophobicContact CB-CD1 4.49Å; F57-I62 HydrophobicContact CB-CG1 3.87Å; P58-I62 PolarHBondContact O-N 3.12Å; P58-I62 VanDerWaalsContact O-N 3.11Å; Q59-I62 PolarHBondContact O-N 3.03Å; I62-F65 PolarHBondContact O-N 3.35Å; I62-K66 WeakPolarHBondContact O-CB 3.43Å; I62-K66 PolarHBondContact O-N 3.13Å
63	Q	90.4	Very high	87.5	Confident	82 Å²	82	65.9 Å²	65.9	38%	0.383	35%	0.353	S	S	.	.	H	α-helix	trans	-67.1	-43	176.6	-176	56.3	44.5	0	0	111.8	Q59 N60 Q61 F65 K66 E67	Q59-Q63 PolarHBondContact O-N 3.36Å; N60-Q63 WeakPolarHBondContact O-CB 3.4Å; N60-Q63 PolarHBondContact O-N 2.86Å; Q61-Q63 PolarHBondContact O-N 2.88Å; Q63-F65 PolarHBondContact O-N 3.47Å; Q63-K66 WeakPolarHBondContact O-CB 3.34Å; Q63-K66 PolarHBondContact O-N 2.98Å; Q63-K66 VanDerWaalsContact O-N 3.14Å; Q63-E67 PolarHBondContact NE2-OE1 2.99Å; Q63-E67 PolarHBondContact O-N 3.17Å
64	E	90.1	Very high	88.4	Confident	113 Å²	113	70.5 Å²	70.5	53%	0.528	37%	0.374	S	S	.	.	H	α-helix	trans	-60.2	-44.1	173.6	-71.5	168.9	-164.3	0	0	111.8	N60 Q61 K66 E67 A68	N60-E64 WeakPolarHBondContact O-CG 3.46Å; N60-E64 PolarHBondContact O-N 3.47Å; Q61-E64 PolarHBondContact O-N 3.23Å; E64-K66 VanDerWaalsContact C-N 3.26Å; E64-K66 PolarHBondContact O-N 2.99Å; E64-E67 PolarHBondContact O-N 2.88Å; E64-A68 WeakPolarHBondContact O-CB 3.46Å; E64-A68 PolarHBondContact O-N 2.8Å
65	F	91.7	Very high	89.2	Confident	23 Å²	23	70.4 Å²	70.4	10%	0.101	38%	0.377	C	S	.	.	H	α-helix	trans	-60.9	-37.5	174.5	-70.2	-54.7	0	0	0	112	F57 Q61 I62 Q63 A68 F69 F114 F117 I118 F121 L125	F57-F65 AromaticContact CD1-CE2 3.93Å; F57-F65 HydrophobicContact CD1-CE2 3.93Å; F57-F65 HydrophobicContact CD2-CE2 4.22Å; F57-F65 AromaticContact CE1-CE2 3.97Å; F57-F65 HydrophobicContact CE1-CE2 3.97Å; F57-F65 HydrophobicContact CE1-CZ 4.16Å; F57-F65 HydrophobicContact CE2-CE2 4.27Å; F57-F65 HydrophobicContact CG-CE2 4.01Å; F57-F65 HydrophobicContact CZ-CE2 4.09Å; F57-F65 HydrophobicContact CZ-CZ 4.25Å; Q61-F65 HydrophobicContact CB-CE2 4.16Å; Q61-F65 WeakPolarHBondContact O-CD2 3.44Å; Q61-F65 WeakPolarHBondContact O-CG 3.4Å; Q61-F65 PolarHBondContact O-N 2.88Å; I62-F65 PolarHBondContact O-N 3.35Å; Q63-F65 PolarHBondContact O-N 3.47Å; F65-A68 PolarHBondContact O-N 3.26Å; F65-F69 VanDerWaalsContact O-CB 3.26Å; F65-F69 WeakPolarHBondContact O-CB 3.44Å; F65-F69 PolarHBondContact O-N 3.09Å; F65-F114 HydrophobicContact CB-CE2 4.08Å; F65-F114 HydrophobicContact CB-CZ 4.38Å; F65-F117 HydrophobicContact CD1-CE1 4.29Å; F65-I118 HydrophobicContact CB-CG1 4.22Å; F65-I118 HydrophobicContact CD2-CG1 4.47Å; F65-I118 HydrophobicContact CG-CG1 4.44Å; F65-F121 HydrophobicContact CD1-CB 4.48Å; F65-F121 HydrophobicContact CD1-CD2 4.3Å; F65-F121 HydrophobicContact CD1-CG 4.17Å; F65-F121 HydrophobicContact CE1-CB 3.76Å; F65-F121 AromaticContact CE1-CD1 3.71Å; F65-F121 HydrophobicContact CE1-CD1 3.71Å; F65-F121 HydrophobicContact CE1-CD2 4.17Å; F65-F121 HydrophobicContact CE1-CE1 4.37Å; F65-F121 AromaticContact CE1-CG 3.59Å; F65-F121 HydrophobicContact CE1-CG 3.59Å; F65-F121 HydrophobicContact CZ-CB 3.98Å; F65-F121 HydrophobicContact CZ-CD1 4.47Å; F65-F121 HydrophobicContact CZ-CG 4.3Å; F65-L125 HydrophobicContact CE1-CD1 4.32Å; F65-L125 HydrophobicContact CZ-CD1 3.73Å
66	K	93.3	Very high	89.9	Confident	113 Å²	113	77.1 Å²	77.1	49%	0.491	38%	0.38	S	S	.	.	H	α-helix	trans	-66.6	-40.1	178	-171	176.7	179	-179.9	0	111.7	I62 Q63 E64 S70 F114	I62-K66 WeakPolarHBondContact O-CB 3.43Å; I62-K66 PolarHBondContact O-N 3.13Å; Q63-K66 WeakPolarHBondContact O-CB 3.34Å; Q63-K66 PolarHBondContact O-N 2.98Å; Q63-K66 VanDerWaalsContact O-N 3.14Å; E64-K66 VanDerWaalsContact C-N 3.26Å; E64-K66 PolarHBondContact O-N 2.99Å; K66-S70 WeakPolarHBondContact O-CB 3.46Å; K66-S70 PolarHBondContact O-N 3.24Å; K66-S70 PolarHBondContact O-OG 3.32Å; K66-F114 VanDerWaalsContact CA-CE2 3.47Å; K66-F114 HydrophobicContact CB-CE2 4.01Å; K66-F114 HydrophobicContact CB-CZ 3.71Å; K66-F114 HydrophobicContact CG-CZ 4.25Å
67	E	94.6	Very high	91	Very high	108 Å²	108	76.8 Å²	76.8	51%	0.505	38%	0.38	S	S	.	.	H	α-helix	trans	-65.7	-46.5	175.1	-73	169.7	-158.7	0	0	110.9	Q63 E64 F69 S70 L71	Q63-E67 PolarHBondContact NE2-OE1 2.99Å; Q63-E67 PolarHBondContact O-N 3.17Å; E64-E67 PolarHBondContact O-N 2.88Å; E67-F69 PolarHBondContact O-N 2.82Å; E67-S70 PolarHBondContact O-N 2.98Å; E67-L71 WeakPolarHBondContact O-CG 3.44Å; E67-L71 PolarHBondContact O-N 2.98Å
68	A	92.9	Very high	91.7	Very high	38 Å²	38	77.6 Å²	77.6	31%	0.314	39%	0.392	S	S	.	.	H	α-helix	trans	-58.5	-46.6	174.2	0	0	0	0	0	111.8	E64 F65 S70 L71 I72 F117	E64-A68 WeakPolarHBondContact O-CB 3.46Å; E64-A68 PolarHBondContact O-N 2.8Å; F65-A68 PolarHBondContact O-N 3.26Å; A68-S70 VanDerWaalsContact C-N 3.33Å; A68-S70 PolarHBondContact O-N 3.14Å; A68-L71 WeakPolarHBondContact O-CB 3.36Å; A68-L71 PolarHBondContact O-N 3.5Å; A68-I72 WeakPolarHBondContact O-CG1 3.41Å; A68-I72 PolarHBondContact O-N 3.24Å; A68-F117 HydrophobicContact CB-CZ 4.47Å
69	F	95.4	Very high	92.5	Very high	11 Å²	11	78.8 Å²	78.8	5%	0.048	39%	0.391	C	S	.	.	H	α-helix	trans	-59.7	-44.4	176.8	-171.3	-87.3	0	0	0	111.4	F65 E67 L71 I72 D73 G78 I80 F114 F117	F65-F69 VanDerWaalsContact O-CB 3.26Å; F65-F69 WeakPolarHBondContact O-CB 3.44Å; F65-F69 PolarHBondContact O-N 3.09Å; E67-F69 PolarHBondContact O-N 2.82Å; F69-L71 PolarHBondContact O-N 3.31Å; F69-I72 PolarHBondContact O-N 3.05Å; F69-I72 VanDerWaalsContact O-N 3.13Å; F69-D73 HydrophobicContact CD1-CB 4.2Å; F69-D73 HydrophobicContact CE1-CB 3.88Å; F69-D73 HydrophobicContact CZ-CB 4.49Å; F69-D73 WeakPolarHBondContact O-CB 3.46Å; F69-D73 PolarHBondContact O-N 3.18Å; F69-G78 WeakPolarHBondContact CZ-O 3.43Å; F69-I80 HydrophobicContact CD2-CD1 3.47Å; F69-I80 VanDerWaalsContact CD2-CD1 3.47Å; F69-I80 HydrophobicContact CD2-CG1 4.11Å; F69-I80 HydrophobicContact CE2-CD1 3.42Å; F69-I80 VanDerWaalsContact CE2-CD1 3.42Å; F69-I80 HydrophobicContact CE2-CG1 3.64Å; F69-I80 HydrophobicContact CG-CD1 4.28Å; F69-I80 HydrophobicContact CZ-CD1 4.19Å; F69-I80 HydrophobicContact CZ-CG1 3.92Å; F69-F114 HydrophobicContact CB-CD2 3.73Å; F69-F114 HydrophobicContact CB-CE2 4.08Å; F69-F114 HydrophobicContact CD1-CB 4.37Å; F69-F114 HydrophobicContact CD1-CD2 4.26Å; F69-F114 HydrophobicContact CD2-CB 4.3Å; F69-F114 AromaticContact CD2-CD2 3.92Å; F69-F114 HydrophobicContact CD2-CD2 3.92Å; F69-F114 HydrophobicContact CE1-CB 4.33Å; F69-F114 HydrophobicContact CE2-CB 4.24Å; F69-F114 HydrophobicContact CG-CB 4.37Å; F69-F114 AromaticContact CG-CD2 3.69Å; F69-F114 HydrophobicContact CG-CD2 3.69Å; F69-F114 HydrophobicContact CG-CG 4.49Å; F69-F114 HydrophobicContact CZ-CB 4.26Å; F69-F117 HydrophobicContact CB-CD1 4.35Å; F69-F117 HydrophobicContact CB-CE1 4.3Å; F69-F117 HydrophobicContact CD2-CB 3.77Å; F69-F117 AromaticContact CD2-CD1 3.98Å; F69-F117 HydrophobicContact CD2-CD1 3.98Å; F69-F117 HydrophobicContact CD2-CD2 4Å; F69-F117 AromaticContact CD2-CG 3.68Å; F69-F117 HydrophobicContact CD2-CG 3.68Å; F69-F117 HydrophobicContact CE2-CB 4.01Å; F69-F117 HydrophobicContact CE2-CG 4.32Å
70	S	94.3	Very high	93.1	Very high	70 Å²	70	72.4 Å²	72.4	49%	0.49	36%	0.362	S	S	.	.	H	α-helix	trans	-69.5	-19.6	179.3	-53.1	0	0	0	0	113.8	K66 E67 A68	K66-S70 WeakPolarHBondContact O-CB 3.46Å; K66-S70 PolarHBondContact O-N 3.24Å; K66-S70 PolarHBondContact O-OG 3.32Å; E67-S70 PolarHBondContact O-N 2.98Å; A68-S70 VanDerWaalsContact C-N 3.33Å; A68-S70 PolarHBondContact O-N 3.14Å
71	L	94.2	Very high	93.7	Very high	130 Å²	130	70.6 Å²	70.6	68%	0.681	35%	0.352	S	S	*	.	H	α-helix	trans	-79	-28.9	172.9	-75.8	167.5	0	0	0	111.9	E67 A68 F69	E67-L71 WeakPolarHBondContact O-CG 3.44Å; E67-L71 PolarHBondContact O-N 2.98Å; A68-L71 WeakPolarHBondContact O-CB 3.36Å; A68-L71 PolarHBondContact O-N 3.5Å; F69-L71 PolarHBondContact O-N 3.31Å
72	I	96	Very high	94.3	Very high	22 Å²	22	69.3 Å²	69.3	11%	0.113	35%	0.347	C	S	.	.	H	α-helix	trans	-85.7	-53.2	179.5	-56.5	168.3	0	0	0	110	A68 F69 Q74 I80 D84 L85 M88 F117	A68-I72 WeakPolarHBondContact O-CG1 3.41Å; A68-I72 PolarHBondContact O-N 3.24Å; F69-I72 PolarHBondContact O-N 3.05Å; F69-I72 VanDerWaalsContact O-N 3.13Å; I72-Q74 VanDerWaalsContact C-N 3.32Å; I72-Q74 WeakPolarHBondContact O-CG 3.36Å; I72-Q74 PolarHBondContact O-N 3.47Å; I72-I80 HydrophobicContact CB-CD1 3.87Å; I72-I80 HydrophobicContact CB-CG1 4.16Å; I72-I80 HydrophobicContact CD1-CD1 4.06Å; I72-I80 HydrophobicContact CG2-CB 4.34Å; I72-I80 HydrophobicContact CG2-CD1 3.76Å; I72-I80 HydrophobicContact CG2-CG1 3.8Å; I72-I80 HydrophobicContact CG2-CG2 3.6Å; I72-D84 HydrophobicContact CG2-CB 4.28Å; I72-D84 WeakPolarHBondContact O-CB 3.45Å; I72-L85 HydrophobicContact CG2-CD2 3.99Å; I72-M88 HydrophobicContact CD1-SD 4.21Å; I72-M88 HydrophobicContact CG1-CG 4.49Å; I72-M88 HydrophobicContact CG1-SD 3.75Å; I72-M88 HydrophobicContact CG2-SD 4.46Å; I72-F117 HydrophobicContact CD1-CE2 3.89Å; I72-F117 HydrophobicContact CD1-CZ 4.07Å
73	D	96.6	Very high	94.6	Very high	11 Å²	11	73.1 Å²	73.1	6%	0.059	36%	0.364	C	S	.	.			trans	-69.1	83.1	176.8	173.9	10.8	0	0	0	110.2	F69 N75 R76 D77 G78 I80	F69-D73 HydrophobicContact CD1-CB 4.2Å; F69-D73 HydrophobicContact CE1-CB 3.88Å; F69-D73 HydrophobicContact CZ-CB 4.49Å; F69-D73 WeakPolarHBondContact O-CB 3.46Å; F69-D73 PolarHBondContact O-N 3.18Å; D73-N75 PolarHBondContact OD1-OD1 2.86Å; D73-R76 WeakPolarHBondContact OD1-CA 3.33Å; D73-R76 PolarHBondContact OD1-N 3.11Å; D73-D77 PolarHBondContact OD1-N 3.03Å; D73-G78 VanDerWaalsContact OD2-CA 3.27Å; D73-G78 WeakPolarHBondContact OD2-CA 3.47Å; D73-G78 PolarHBondContact OD2-N 2.96Å; D73-I80 HydrophobicContact CB-CG1 4.3Å
74	Q	93	Very high	95	Very high	99 Å²	99	69.3 Å²	69.3	46%	0.463	35%	0.347	S	S	.	.	S	Bend	trans	-77.1	-33.3	-174	-66.3	-157.8	-9.1	0	0	111.8	I72 R76 D84	I72-Q74 VanDerWaalsContact C-N 3.32Å; I72-Q74 WeakPolarHBondContact O-CG 3.36Å; I72-Q74 PolarHBondContact O-N 3.47Å; Q74-R76 VanDerWaalsContact C-N 3.26Å; Q74-D84 PolarHBondContact N-OD1 3.02Å
75	N	94.5	Very high	95.3	Very high	85 Å²	85	64.4 Å²	64.4	46%	0.455	32%	0.324	S	S	.	.	S	Bend	trans	-77.1	-15.2	179.2	75.9	18.3	0	0	0	112.4	D73 D77	D73-N75 PolarHBondContact OD1-OD1 2.86Å; N75-D77 VanDerWaalsContact C-N 3.33Å; N75-D77 PolarHBondContact ND2-OD2 3.49Å; N75-D77 VanDerWaalsContact OD1-CB 3.31Å; N75-D77 WeakPolarHBondContact OD1-CB 3.45Å; N75-D77 PolarHBondContact OD1-N 3.44Å; N75-D77 PolarHBondContact OD1-OD1 2.91Å
76	R	93.7	Very high	95.4	Very high	214 Å²	214	65.9 Å²	65.9	81%	0.808	33%	0.33	S	S	*	.			trans	62.2	33.5	178.3	-55.5	-175.9	176.9	-164.5	-1.8	113.9	D73 Q74 G78	D73-R76 WeakPolarHBondContact OD1-CA 3.33Å; D73-R76 PolarHBondContact OD1-N 3.11Å; Q74-R76 VanDerWaalsContact C-N 3.26Å; R76-G78 VanDerWaalsContact C-N 3.29Å
77	D	97	Very high	95.5	Very high	89 Å²	89	64.1 Å²	64.1	48%	0.476	33%	0.326	S	S	.	.	S	Bend	trans	-83.6	-8.1	176.6	78.6	8.1	0	0	0	113	D73 N75 F79	D73-D77 PolarHBondContact OD1-N 3.03Å; N75-D77 VanDerWaalsContact C-N 3.33Å; N75-D77 PolarHBondContact ND2-OD2 3.49Å; N75-D77 VanDerWaalsContact OD1-CB 3.31Å; N75-D77 WeakPolarHBondContact OD1-CB 3.45Å; N75-D77 PolarHBondContact OD1-N 3.44Å; N75-D77 PolarHBondContact OD1-OD1 2.91Å; D77-F79 WeakPolarHBondContact OD1-CA 3.44Å; D77-F79 WeakPolarHBondContact OD1-CB 3.26Å; D77-F79 PolarHBondContact OD1-N 3.49Å; D77-F79 VanDerWaalsContact OD1-O 3.06Å
78	G	96.3	Very high	95.5	Very high	30 Å²	30	60.6 Å²	60.6	31%	0.309	31%	0.31	S	S	.	.	S	Bend	trans	89.4	6.2	178.9	0	0	0	0	0	114.4	F69 D73 R76 N113	F69-G78 WeakPolarHBondContact CZ-O 3.43Å; D73-G78 VanDerWaalsContact OD2-CA 3.27Å; D73-G78 WeakPolarHBondContact OD2-CA 3.47Å; D73-G78 PolarHBondContact OD2-N 2.96Å; R76-G78 VanDerWaalsContact C-N 3.29Å; G78-N113 WeakPolarHBondContact O-CA 3.3Å
79	F	97.4	Very high	95.6	Very high	90 Å²	90	61 Å²	61	40%	0.395	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	143.8	176	-62.5	-91.4	0	0	0	109.6	D77 P111 L112 N113	D77-F79 WeakPolarHBondContact OD1-CA 3.44Å; D77-F79 WeakPolarHBondContact OD1-CB 3.26Å; D77-F79 PolarHBondContact OD1-N 3.49Å; D77-F79 VanDerWaalsContact OD1-O 3.06Å; F79-P111 HydrophobicContact CD1-CB 3.68Å; F79-P111 HydrophobicContact CE1-CB 3.75Å; F79-L112 WeakPolarHBondContact CA-O 3.01Å; F79-N113 HydrophobicContact CD1-CB 3.89Å; F79-N113 HydrophobicContact CE1-CB 3.77Å; F79-N113 HydrophobicContact CZ-CB 4.47Å
80	I	97.2	Very high	95.4	Very high	7 Å²	7	63.3 Å²	63.3	4%	0.036	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	119.1	170	-67.4	167.9	0	0	0	107.6	F69 I72 D73 D84 L85 L105 L112 F117	F69-I80 HydrophobicContact CD2-CD1 3.47Å; F69-I80 VanDerWaalsContact CD2-CD1 3.47Å; F69-I80 HydrophobicContact CD2-CG1 4.11Å; F69-I80 HydrophobicContact CE2-CD1 3.42Å; F69-I80 VanDerWaalsContact CE2-CD1 3.42Å; F69-I80 HydrophobicContact CE2-CG1 3.64Å; F69-I80 HydrophobicContact CG-CD1 4.28Å; F69-I80 HydrophobicContact CZ-CD1 4.19Å; F69-I80 HydrophobicContact CZ-CG1 3.92Å; I72-I80 HydrophobicContact CB-CD1 3.87Å; I72-I80 HydrophobicContact CB-CG1 4.16Å; I72-I80 HydrophobicContact CD1-CD1 4.06Å; I72-I80 HydrophobicContact CG2-CB 4.34Å; I72-I80 HydrophobicContact CG2-CD1 3.76Å; I72-I80 HydrophobicContact CG2-CG1 3.8Å; I72-I80 HydrophobicContact CG2-CG2 3.6Å; D73-I80 HydrophobicContact CB-CG1 4.3Å; I80-D84 HydrophobicContact CG2-CB 4.31Å; I80-L85 HydrophobicContact CG2-CD2 3.97Å; I80-L85 HydrophobicContact CG2-CG 3.97Å; I80-L105 HydrophobicContact CG2-CD2 4.3Å; I80-L105 WeakPolarHBondContact O-CD2 3.48Å; I80-L112 HydrophobicContact CB-CB 4.44Å; I80-L112 HydrophobicContact CB-CD2 3.99Å; I80-L112 HydrophobicContact CB-CG 4.2Å; I80-L112 HydrophobicContact CD1-CD2 4.4Å; I80-L112 HydrophobicContact CG2-CD2 4.15Å; I80-L112 PolarHBondContact N-O 2.81Å; I80-F117 HydrophobicContact CD1-CD2 3.8Å; I80-F117 HydrophobicContact CD1-CE2 3.9Å
81	D	96.4	Very high	95.3	Very high	59 Å²	59	64.3 Å²	64.3	32%	0.316	33%	0.332	S	S	.	.			trans	-109.7	-173.2	173.6	78.2	19.6	0	0	0	113	E83 D84 L85	D81-E83 VanDerWaalsContact C-N 3.32Å; D81-E83 WeakPolarHBondContact OD1-CA 3.45Å; D81-E83 WeakPolarHBondContact OD1-CB 3.49Å; D81-E83 PolarHBondContact OD1-N 3.13Å; D81-D84 PolarHBondContact N-OD2 3.24Å; D81-D84 PolarHBondContact OD1-N 2.99Å; D81-L85 WeakPolarHBondContact O-CG 3.37Å; D81-L85 PolarHBondContact O-N 2.87Å
82	I	96.6	Very high	95.2	Very high	44 Å²	44	63.5 Å²	63.5	23%	0.226	33%	0.328	C	S	.	.	H	α-helix	trans	-69.5	-31.2	-177.8	-167.7	170.2	0	0	0	112.4	L85 K86 D98 L101 L105	I82-L85 PolarHBondContact O-N 2.96Å; I82-K86 VanDerWaalsContact O-CG 3.3Å; I82-K86 WeakPolarHBondContact O-CG 3.01Å; I82-K86 PolarHBondContact O-N 3.42Å; I82-D98 HydrophobicContact CD1-CB 4.1Å; I82-L101 HydrophobicContact CD1-CB 4.27Å; I82-L101 HydrophobicContact CG1-CB 3.92Å; I82-L101 HydrophobicContact CG1-CD1 4.12Å; I82-L105 HydrophobicContact CB-CD1 3.94Å
83	E	96.2	Very high	95	Very high	97 Å²	97	65.8 Å²	65.8	45%	0.453	36%	0.357	S	S	.	.	H	α-helix	trans	-75.1	-39.3	-179.7	-59.6	-58.3	126.8	0	0	109.9	D81 L85 K86 D87	D81-E83 VanDerWaalsContact C-N 3.32Å; D81-E83 WeakPolarHBondContact OD1-CA 3.45Å; D81-E83 WeakPolarHBondContact OD1-CB 3.49Å; D81-E83 PolarHBondContact OD1-N 3.13Å; E83-L85 VanDerWaalsContact C-N 3.31Å; E83-L85 PolarHBondContact O-N 3.04Å; E83-K86 WeakPolarHBondContact O-CB 3.26Å; E83-K86 PolarHBondContact O-N 2.94Å; E83-K86 VanDerWaalsContact O-N 3.12Å; E83-K86 IonicContact OE1-NZ 2.89Å; E83-K86 PolarHBondContact OE1-NZ 2.65Å; E83-D87 PolarHBondContact O-N 3.32Å
84	D	97.2	Very high	94.9	Very high	3 Å²	3	73.4 Å²	73.4	2%	0.016	39%	0.385	C	S	.	.	H	α-helix	trans	-55.6	-45.2	170.2	-70.7	-48.5	0	0	0	112.1	I72 Q74 I80 D81 D87 M88	I72-D84 HydrophobicContact CG2-CB 4.28Å; I72-D84 WeakPolarHBondContact O-CB 3.45Å; Q74-D84 PolarHBondContact N-OD1 3.02Å; I80-D84 HydrophobicContact CG2-CB 4.31Å; D81-D84 PolarHBondContact N-OD2 3.24Å; D81-D84 PolarHBondContact OD1-N 2.99Å; D84-D87 PolarHBondContact O-N 2.89Å; D84-M88 WeakPolarHBondContact O-CB 3.46Å; D84-M88 PolarHBondContact O-N 3.19Å
85	L	96.1	Very high	94.9	Very high	9 Å²	9	75 Å²	75	5%	0.047	40%	0.402	C	S	.	.	H	α-helix	trans	-65.9	-40.9	176.6	-68.7	178.3	0	0	0	111.9	I72 I80 D81 I82 E83 D87 M88 Y89 L101 M104 L105	I72-L85 HydrophobicContact CG2-CD2 3.99Å; I80-L85 HydrophobicContact CG2-CD2 3.97Å; I80-L85 HydrophobicContact CG2-CG 3.97Å; D81-L85 WeakPolarHBondContact O-CG 3.37Å; D81-L85 PolarHBondContact O-N 2.87Å; I82-L85 PolarHBondContact O-N 2.96Å; E83-L85 VanDerWaalsContact C-N 3.31Å; E83-L85 PolarHBondContact O-N 3.04Å; L85-D87 VanDerWaalsContact C-N 3.34Å; L85-M88 HydrophobicContact CD2-CE 4.16Å; L85-M88 PolarHBondContact O-N 3.36Å; L85-Y89 WeakPolarHBondContact O-CB 3.25Å; L85-Y89 WeakPolarHBondContact O-CD2 3.32Å; L85-Y89 PolarHBondContact O-N 2.6Å; L85-L101 HydrophobicContact CB-CD1 4.32Å; L85-L101 HydrophobicContact CB-CD2 4Å; L85-L101 HydrophobicContact CD1-CB 4.39Å; L85-L101 HydrophobicContact CD1-CD2 4.4Å; L85-M104 HydrophobicContact CD2-CE 4.5Å; L85-L105 HydrophobicContact CD1-CD1 4.26Å; L85-L105 HydrophobicContact CD1-CD2 3.79Å; L85-L105 HydrophobicContact CD1-CG 3.79Å
86	K	95.5	Very high	94.8	Very high	54 Å²	54	72.6 Å²	72.6	24%	0.235	39%	0.391	C	S	.	.	H	α-helix	trans	-59.8	-46.4	175.7	-77.2	172	-178.5	170.6	0	111	I82 E83 Y89 A90 D98 L101	I82-K86 VanDerWaalsContact O-CG 3.3Å; I82-K86 WeakPolarHBondContact O-CG 3.01Å; I82-K86 PolarHBondContact O-N 3.42Å; E83-K86 WeakPolarHBondContact O-CB 3.26Å; E83-K86 PolarHBondContact O-N 2.94Å; E83-K86 VanDerWaalsContact O-N 3.12Å; E83-K86 IonicContact OE1-NZ 2.89Å; E83-K86 PolarHBondContact OE1-NZ 2.65Å; K86-Y89 PolarHBondContact O-N 2.94Å; K86-A90 VanDerWaalsContact O-CB 3.24Å; K86-A90 WeakPolarHBondContact O-CB 3.31Å; K86-A90 PolarHBondContact O-N 2.8Å; K86-D98 WeakPolarHBondContact CE-OD1 3.08Å; K86-D98 IonicContact NZ-OD1 2.7Å; K86-D98 PolarHBondContact NZ-OD1 3.08Å; K86-D98 IonicContact NZ-OD2 2.86Å; K86-D98 PolarHBondContact NZ-OD2 3.31Å; K86-D98 VanDerWaalsContact NZ-OD2 3.07Å; K86-L101 HydrophobicContact CB-CD1 4.45Å; K86-L101 HydrophobicContact CG-CD1 3.44Å; K86-L101 VanDerWaalsContact CG-CD1 3.44Å
87	D	94.5	Very high	94.9	Very high	76 Å²	76	66 Å²	66	41%	0.406	37%	0.374	S	S	.	.	H	α-helix	trans	-65.8	-42.1	179.9	-73.2	-23.1	0	0	0	111.5	E83 D84 L85 A90 S91	E83-D87 PolarHBondContact O-N 3.32Å; D84-D87 PolarHBondContact O-N 2.89Å; L85-D87 VanDerWaalsContact C-N 3.34Å; D87-A90 PolarHBondContact O-N 3.25Å; D87-S91 PolarHBondContact O-N 2.85Å
88	M	94.6	Very high	94.9	Very high	35 Å²	35	66.1 Å²	66.1	17%	0.172	38%	0.375	C	S	.	.	H	α-helix	trans	-57.7	-52.7	172.6	-178.1	-158.4	64.5	0	0	111	I72 D84 L85 A90 S91 L92	I72-M88 HydrophobicContact CD1-SD 4.21Å; I72-M88 HydrophobicContact CG1-CG 4.49Å; I72-M88 HydrophobicContact CG1-SD 3.75Å; I72-M88 HydrophobicContact CG2-SD 4.46Å; D84-M88 WeakPolarHBondContact O-CB 3.46Å; D84-M88 PolarHBondContact O-N 3.19Å; L85-M88 HydrophobicContact CD2-CE 4.16Å; L85-M88 PolarHBondContact O-N 3.36Å; M88-A90 VanDerWaalsContact C-N 3.35Å; M88-A90 PolarHBondContact O-N 2.8Å; M88-S91 WeakPolarHBondContact O-CB 3.34Å; M88-S91 PolarHBondContact O-N 3.3Å; M88-S91 PolarHBondContact O-OG 3.26Å; M88-L92 PolarHBondContact O-N 2.62Å
89	Y	94.5	Very high	94.9	Very high	46 Å²	46	71.5 Å²	71.5	18%	0.18	39%	0.39	C	S	.	.	H	α-helix	trans	-66.9	-35.8	-178.4	-84.8	-71.7	0	0	0	112.7	L85 K86 S91 L92 G93 R94 P96 L101 M104	L85-Y89 WeakPolarHBondContact O-CB 3.25Å; L85-Y89 WeakPolarHBondContact O-CD2 3.32Å; L85-Y89 PolarHBondContact O-N 2.6Å; K86-Y89 PolarHBondContact O-N 2.94Å; Y89-S91 VanDerWaalsContact C-N 3.27Å; Y89-S91 PolarHBondContact O-N 3.01Å; Y89-L92 HydrophobicContact CD1-CD1 4.48Å; Y89-L92 CarbonylContact O-C 3.44Å; Y89-L92 WeakPolarHBondContact O-CA 3.43Å; Y89-L92 WeakPolarHBondContact O-CB 3.24Å; Y89-L92 PolarHBondContact O-N 3Å; Y89-G93 PolarHBondContact O-N 3.17Å; Y89-G93 VanDerWaalsContact O-N 3.16Å; Y89-R94 CarbonylContact C-O 3.53Å; Y89-R94 HydrophobicContact CD1-CB 3.99Å; Y89-R94 PolarHBondContact O-N 3.01Å; Y89-P96 HydrophobicContact CD1-CG 3.61Å; Y89-P96 HydrophobicContact CD2-CG 3.61Å; Y89-P96 HydrophobicContact CE1-CG 3.9Å; Y89-P96 HydrophobicContact CE2-CG 3.9Å; Y89-P96 HydrophobicContact CG-CG 3.45Å; Y89-P96 VanDerWaalsContact CG-CG 3.45Å; Y89-L101 HydrophobicContact CD2-CD2 3.66Å; Y89-L101 HydrophobicContact CE2-CD2 3.61Å; Y89-M104 HydrophobicContact CE2-CE 4.19Å; Y89-M104 HydrophobicContact CE2-SD 4.13Å
90	A	92.7	Very high	94.8	Very high	60 Å²	60	71.9 Å²	71.9	50%	0.496	39%	0.393	S	S	.	.	H	α-helix	trans	-59	-40.6	172.7	0	0	0	0	0	111.2	K86 D87 M88 L92 G93 R94	K86-A90 VanDerWaalsContact O-CB 3.24Å; K86-A90 WeakPolarHBondContact O-CB 3.31Å; K86-A90 PolarHBondContact O-N 2.8Å; D87-A90 PolarHBondContact O-N 3.25Å; M88-A90 VanDerWaalsContact C-N 3.35Å; M88-A90 PolarHBondContact O-N 2.8Å; A90-L92 PolarHBondContact O-N 3.4Å; A90-G93 PolarHBondContact O-N 3.11Å; A90-R94 PolarHBondContact N-O 2.88Å
91	S	90.9	Very high	94.7	Very high	90 Å²	90	71.6 Å²	71.6	63%	0.629	39%	0.391	S	S	*	.	H	α-helix	trans	-63.6	-26.7	174.6	83.6	0	0	0	0	113.4	D87 M88 Y89 G93	D87-S91 PolarHBondContact O-N 2.85Å; M88-S91 WeakPolarHBondContact O-CB 3.34Å; M88-S91 PolarHBondContact O-N 3.3Å; M88-S91 PolarHBondContact O-OG 3.26Å; Y89-S91 VanDerWaalsContact C-N 3.27Å; Y89-S91 PolarHBondContact O-N 3.01Å; S91-G93 VanDerWaalsContact C-N 3.34Å
92	L	92.1	Very high	94.7	Very high	113 Å²	113	74.6 Å²	74.6	59%	0.592	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.2	2.5	174.9	-61	175	0	0	0	113.3	M88 Y89 A90 R94	M88-L92 PolarHBondContact O-N 2.62Å; Y89-L92 HydrophobicContact CD1-CD1 4.48Å; Y89-L92 CarbonylContact O-C 3.44Å; Y89-L92 WeakPolarHBondContact O-CA 3.43Å; Y89-L92 WeakPolarHBondContact O-CB 3.24Å; Y89-L92 PolarHBondContact O-N 3Å; A90-L92 PolarHBondContact O-N 3.4Å; L92-R94 VanDerWaalsContact C-N 3.27Å; L92-R94 PolarHBondContact O-N 3.43Å
93	G	92.9	Very high	94.6	Very high	71 Å²	71	77.6 Å²	77.6	73%	0.732	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	69	22	-177.1	0	0	0	0	0	114.1	Y89 A90 S91	Y89-G93 PolarHBondContact O-N 3.17Å; Y89-G93 VanDerWaalsContact O-N 3.16Å; A90-G93 PolarHBondContact O-N 3.11Å; S91-G93 VanDerWaalsContact C-N 3.34Å
94	R	93.2	Very high	94.4	Very high	170 Å²	170	76.4 Å²	76.4	64%	0.642	41%	0.41	S	S	*	.			trans	-114.8	150.4	177.2	-65.5	-171.8	-179.1	-174	1.4	110.4	Y89 A90 L92	Y89-R94 CarbonylContact C-O 3.53Å; Y89-R94 HydrophobicContact CD1-CB 3.99Å; Y89-R94 PolarHBondContact O-N 3.01Å; A90-R94 PolarHBondContact N-O 2.88Å; L92-R94 VanDerWaalsContact C-N 3.27Å; L92-R94 PolarHBondContact O-N 3.43Å
95	T	92.6	Very high	94.3	Very high	134 Å²	134	77.9 Å²	77.9	82%	0.822	42%	0.418	S	S	*	.			trans	-131.5	77.9	177.3	56.7	0	0	0	0	109.8
96	P	93.5	Very high	94.2	Very high	33 Å²	33	82.7 Å²	82.7	21%	0.214	44%	0.444	C	S	.	.			trans	-59.7	155.4	170.5	-18.9	32.4	0	0	0	110.7	Y89 E100 L101	Y89-P96 HydrophobicContact CD1-CG 3.61Å; Y89-P96 HydrophobicContact CD2-CG 3.61Å; Y89-P96 HydrophobicContact CE1-CG 3.9Å; Y89-P96 HydrophobicContact CE2-CG 3.9Å; Y89-P96 HydrophobicContact CG-CG 3.45Å; Y89-P96 VanDerWaalsContact CG-CG 3.45Å; P96-E100 HydrophobicContact CB-CB 4.39Å; P96-L101 HydrophobicContact CB-CD2 3.76Å; P96-L101 HydrophobicContact CB-CG 4.06Å; P96-L101 HydrophobicContact CG-CD2 4.01Å
97	T	95.9	Very high	93.9	Very high	76 Å²	76	85 Å²	85	47%	0.466	46%	0.455	S	S	.	.			trans	-74.4	150.5	174.8	63	0	0	0	0	110.8	K99 E100 L101	T97-K99 PolarHBondContact O-N 3.45Å; T97-E100 WeakPolarHBondContact CB-OE2 3.28Å; T97-E100 PolarHBondContact N-OE2 3.44Å; T97-E100 PolarHBondContact O-N 3.35Å; T97-E100 WeakPolarHBondContact OG1-CG 3.3Å; T97-E100 PolarHBondContact OG1-N 2.9Å; T97-E100 PolarHBondContact OG1-OE2 3.07Å; T97-L101 PolarHBondContact O-N 3.5Å
98	D	96.1	Very high	93.6	Very high	91 Å²	91	81.9 Å²	81.9	49%	0.487	44%	0.439	S	S	.	.	H	α-helix	trans	-54	-28.5	174.2	-73.2	28	0	0	0	112.5	I82 K86 K102	I82-D98 HydrophobicContact CD1-CB 4.1Å; K86-D98 WeakPolarHBondContact CE-OD1 3.08Å; K86-D98 IonicContact NZ-OD1 2.7Å; K86-D98 PolarHBondContact NZ-OD1 3.08Å; K86-D98 IonicContact NZ-OD2 2.86Å; K86-D98 PolarHBondContact NZ-OD2 3.31Å; K86-D98 VanDerWaalsContact NZ-OD2 3.07Å; D98-K102 WeakPolarHBondContact O-CB 3.49Å; D98-K102 PolarHBondContact O-N 2.83Å
99	K	96.8	Very high	93.3	Very high	144 Å²	144	86.1 Å²	86.1	63%	0.626	47%	0.469	S	S	*	.	H	α-helix	trans	-65.6	-49.5	174.5	-174.5	-174.3	169.9	-163.2	0	111.7	T97 K102 E103	T97-K99 PolarHBondContact O-N 3.45Å; K99-K102 PolarHBondContact O-N 3.49Å; K99-E103 WeakPolarHBondContact CE-OE1 3.45Å; K99-E103 IonicContact NZ-OE1 3.74Å; K99-E103 WeakPolarHBondContact O-CG 3.21Å; K99-E103 PolarHBondContact O-N 2.69Å
100	E	94.3	Very high	93.1	Very high	98 Å²	98	85.5 Å²	85.5	46%	0.458	48%	0.477	S	S	.	.	H	α-helix	trans	-62.7	-43.3	178.5	-71.2	161.9	137.4	0	0	111.1	P96 T97 K102 E103 M104	P96-E100 HydrophobicContact CB-CB 4.39Å; T97-E100 WeakPolarHBondContact CB-OE2 3.28Å; T97-E100 PolarHBondContact N-OE2 3.44Å; T97-E100 PolarHBondContact O-N 3.35Å; T97-E100 WeakPolarHBondContact OG1-CG 3.3Å; T97-E100 PolarHBondContact OG1-N 2.9Å; T97-E100 PolarHBondContact OG1-OE2 3.07Å; E100-K102 VanDerWaalsContact C-N 3.33Å; E100-K102 PolarHBondContact O-N 3.41Å; E100-E103 PolarHBondContact O-N 2.99Å; E100-M104 WeakPolarHBondContact O-CG 3.03Å; E100-M104 PolarHBondContact O-N 3.38Å
101	L	96.2	Very high	93.2	Very high	1 Å²	1	87.1 Å²	87.1	1%	0.005	48%	0.483	C	S	.	.	H	α-helix	trans	-64.7	-39.1	177.8	-60.8	-177.1	0	0	0	112.1	I82 L85 K86 Y89 P96 T97 M104 L105	I82-L101 HydrophobicContact CD1-CB 4.27Å; I82-L101 HydrophobicContact CG1-CB 3.92Å; I82-L101 HydrophobicContact CG1-CD1 4.12Å; L85-L101 HydrophobicContact CB-CD1 4.32Å; L85-L101 HydrophobicContact CB-CD2 4Å; L85-L101 HydrophobicContact CD1-CB 4.39Å; L85-L101 HydrophobicContact CD1-CD2 4.4Å; K86-L101 HydrophobicContact CB-CD1 4.45Å; K86-L101 HydrophobicContact CG-CD1 3.44Å; K86-L101 VanDerWaalsContact CG-CD1 3.44Å; Y89-L101 HydrophobicContact CD2-CD2 3.66Å; Y89-L101 HydrophobicContact CE2-CD2 3.61Å; P96-L101 HydrophobicContact CB-CD2 3.76Å; P96-L101 HydrophobicContact CB-CG 4.06Å; P96-L101 HydrophobicContact CG-CD2 4.01Å; T97-L101 PolarHBondContact O-N 3.5Å; L101-M104 HydrophobicContact CD2-SD 4.15Å; L101-M104 WeakPolarHBondContact O-CB 3.43Å; L101-M104 PolarHBondContact O-N 3.1Å; L101-L105 WeakPolarHBondContact O-CG 3.43Å; L101-L105 PolarHBondContact O-N 3.2Å; L101-L105 VanDerWaalsContact O-N 3.08Å
102	K	95.5	Very high	93.4	Very high	122 Å²	122	83.8 Å²	83.8	53%	0.53	46%	0.457	S	S	.	.	H	α-helix	trans	-65.5	-42.5	175.2	-178.3	167.3	-177.3	150	0	112.1	D98 K99 E100 M104 L105 D106	D98-K102 WeakPolarHBondContact O-CB 3.49Å; D98-K102 PolarHBondContact O-N 2.83Å; K99-K102 PolarHBondContact O-N 3.49Å; E100-K102 VanDerWaalsContact C-N 3.33Å; E100-K102 PolarHBondContact O-N 3.41Å; K102-M104 PolarHBondContact O-N 3.47Å; K102-L105 PolarHBondContact O-N 2.93Å; K102-L105 VanDerWaalsContact O-N 3.15Å; K102-D106 WeakPolarHBondContact O-CB 3.45Å; K102-D106 VanDerWaalsContact O-CG 3.26Å; K102-D106 PolarHBondContact O-N 3.04Å
103	E	95.5	Very high	93.5	Very high	106 Å²	106	80.6 Å²	80.6	50%	0.495	44%	0.441	S	S	.	.	H	α-helix	trans	-59.7	-35.8	174.6	-74.6	173.4	176.4	0	0	111.6	K99 E100 E107	K99-E103 WeakPolarHBondContact CE-OE1 3.45Å; K99-E103 IonicContact NZ-OE1 3.74Å; K99-E103 WeakPolarHBondContact O-CG 3.21Å; K99-E103 PolarHBondContact O-N 2.69Å; E100-E103 PolarHBondContact O-N 2.99Å; E103-E107 PolarHBondContact O-N 3.35Å
104	M	92.1	Very high	93.6	Very high	72 Å²	72	79.3 Å²	79.3	36%	0.355	42%	0.415	S	S	.	.	H	α-helix	trans	-65	-44.4	172.9	-67.4	172.9	64.1	0	0	112.5	L85 Y89 E100 L101 K102 D106 E107	L85-M104 HydrophobicContact CD2-CE 4.5Å; Y89-M104 HydrophobicContact CE2-CE 4.19Å; Y89-M104 HydrophobicContact CE2-SD 4.13Å; E100-M104 WeakPolarHBondContact O-CG 3.03Å; E100-M104 PolarHBondContact O-N 3.38Å; L101-M104 HydrophobicContact CD2-SD 4.15Å; L101-M104 WeakPolarHBondContact O-CB 3.43Å; L101-M104 PolarHBondContact O-N 3.1Å; K102-M104 PolarHBondContact O-N 3.47Å; M104-D106 VanDerWaalsContact C-N 3.33Å; M104-E107 WeakPolarHBondContact O-CB 3.42Å; M104-E107 PolarHBondContact O-N 3.48Å
105	L	94.4	Very high	93.6	Very high	34 Å²	34	73.2 Å²	73.2	18%	0.178	40%	0.397	C	S	.	.	H	α-helix	trans	-67.7	-35.3	178.7	-67.8	170.6	0	0	0	112.1	I80 I82 L85 L101 K102 E107 S108 L112	I80-L105 HydrophobicContact CG2-CD2 4.3Å; I80-L105 WeakPolarHBondContact O-CD2 3.48Å; I82-L105 HydrophobicContact CB-CD1 3.94Å; L85-L105 HydrophobicContact CD1-CD1 4.26Å; L85-L105 HydrophobicContact CD1-CD2 3.79Å; L85-L105 HydrophobicContact CD1-CG 3.79Å; L101-L105 WeakPolarHBondContact O-CG 3.43Å; L101-L105 PolarHBondContact O-N 3.2Å; L101-L105 VanDerWaalsContact O-N 3.08Å; K102-L105 PolarHBondContact O-N 2.93Å; K102-L105 VanDerWaalsContact O-N 3.15Å; L105-E107 PolarHBondContact O-N 3.34Å; L105-S108 WeakPolarHBondContact O-CB 3.46Å; L105-S108 PolarHBondContact O-N 3.15Å; L105-S108 VanDerWaalsContact O-N 3.09Å; L105-L112 HydrophobicContact CD2-CD2 4.12Å
106	D	93.8	Very high	93.5	Very high	111 Å²	111	69 Å²	69	59%	0.594	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.7	-10.3	178.9	-72.8	-16.8	0	0	0	112.9	K102 M104 S108	K102-D106 WeakPolarHBondContact O-CB 3.45Å; K102-D106 VanDerWaalsContact O-CG 3.26Å; K102-D106 PolarHBondContact O-N 3.04Å; M104-D106 VanDerWaalsContact C-N 3.33Å; D106-S108 PolarHBondContact O-N 2.96Å
107	E	89.4	Confident	93.5	Very high	102 Å²	102	68.1 Å²	68.1	48%	0.477	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-28.5	167.5	-67.9	-166.3	157.8	0	0	111.7	E103 M104 L105 L120 K124	E103-E107 PolarHBondContact O-N 3.35Å; M104-E107 WeakPolarHBondContact O-CB 3.42Å; M104-E107 PolarHBondContact O-N 3.48Å; L105-E107 PolarHBondContact O-N 3.34Å; E107-L120 HydrophobicContact CB-CD2 4.24Å; E107-L120 WeakPolarHBondContact O-CD2 3.21Å; E107-K124 IonicContact OE1-NZ 3.07Å; E107-K124 PolarHBondContact OE1-NZ 3.48Å; E107-K124 IonicContact OE2-NZ 3.38Å; E107-K124 PolarHBondContact OE2-NZ 2.64Å
108	S	89.5	Confident	93.2	Very high	10 Å²	10	64.5 Å²	64.5	7%	0.07	34%	0.339	C	S	.	.	S	Bend	trans	-80.9	133.6	175.4	-176.8	0	0	0	0	110.5	L105 D106 G110	L105-S108 WeakPolarHBondContact O-CB 3.46Å; L105-S108 PolarHBondContact O-N 3.15Å; L105-S108 VanDerWaalsContact O-N 3.09Å; D106-S108 PolarHBondContact O-N 2.96Å; S108-G110 VanDerWaalsContact CB-O 3.26Å; S108-G110 WeakPolarHBondContact CB-O 3.36Å; S108-G110 PolarHBondContact O-N 3.09Å; S108-G110 PolarHBondContact OG-O 3.4Å
109	P	87.6	Confident	92.7	Very high	124 Å²	124	61 Å²	61	81%	0.805	32%	0.32	S	S	*	.	S	Bend	trans	-68.4	-0.3	177.9	29.6	-36.4	0	0	0	114.1	M116	P109-M116 HydrophobicContact CG-SD 4.45Å
110	G	90.8	Very high	92.2	Very high	33 Å²	33	55.1 Å²	55.1	34%	0.34	30%	0.296	S	S	.	.	S	Bend	trans	-171.9	-168.5	179.1	0	0	0	0	0	111.3	S108 L112	S108-G110 VanDerWaalsContact CB-O 3.26Å; S108-G110 WeakPolarHBondContact CB-O 3.36Å; S108-G110 PolarHBondContact O-N 3.09Å; S108-G110 PolarHBondContact OG-O 3.4Å; G110-L112 PolarHBondContact O-N 3.25Å
111	P	93.4	Very high	91.6	Very high	95 Å²	95	54.3 Å²	54.3	62%	0.617	29%	0.291	S	S	*	.	S	Bend	trans	-51.7	130.7	179.9	-27.2	35.3	0	0	0	112.5	F79 N113	F79-P111 HydrophobicContact CD1-CB 3.68Å; F79-P111 HydrophobicContact CE1-CB 3.75Å; P111-N113 VanDerWaalsContact C-N 3.33Å; P111-N113 PolarHBondContact O-N 3.41Å
112	L	95.3	Very high	90.7	Very high	19 Å²	19	54.4 Å²	54.4	10%	0.099	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	77.5	-171.7	-174.7	57.2	0	0	0	111.2	F79 I80 L105 G110 M116 F117 L120	F79-L112 WeakPolarHBondContact CA-O 3.01Å; I80-L112 HydrophobicContact CB-CB 4.44Å; I80-L112 HydrophobicContact CB-CD2 3.99Å; I80-L112 HydrophobicContact CB-CG 4.2Å; I80-L112 HydrophobicContact CD1-CD2 4.4Å; I80-L112 HydrophobicContact CG2-CD2 4.15Å; I80-L112 PolarHBondContact N-O 2.81Å; L105-L112 HydrophobicContact CD2-CD2 4.12Å; G110-L112 PolarHBondContact O-N 3.25Å; L112-M116 HydrophobicContact CD1-CB 3.93Å; L112-F117 HydrophobicContact CD1-CB 4.12Å; L112-L120 HydrophobicContact CD1-CD1 3.72Å
113	N	95.5	Very high	89.8	Confident	47 Å²	47	55.1 Å²	55.1	25%	0.251	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	172.9	168.2	65.3	38.4	0	0	0	111.5	G78 F79 P111 T115 M116 F117	G78-N113 WeakPolarHBondContact O-CA 3.3Å; F79-N113 HydrophobicContact CD1-CB 3.89Å; F79-N113 HydrophobicContact CE1-CB 3.77Å; F79-N113 HydrophobicContact CZ-CB 4.47Å; P111-N113 VanDerWaalsContact C-N 3.33Å; P111-N113 PolarHBondContact O-N 3.41Å; N113-T115 PolarHBondContact O-N 2.76Å; N113-T115 VanDerWaalsContact O-N 3.13Å; N113-T115 WeakPolarHBondContact OD1-CB 3.42Å; N113-T115 PolarHBondContact OD1-N 2.94Å; N113-M116 PolarHBondContact O-N 3.3Å; N113-M116 PolarHBondContact OD1-N 3.16Å; N113-F117 PolarHBondContact O-N 3.07Å
114	F	94.5	Very high	88.6	Confident	44 Å²	44	56.6 Å²	56.6	19%	0.193	30%	0.302	C	S	.	.	H	α-helix	trans	-54.5	-35.1	-179.9	-176.1	-122.3	0	0	0	114.6	F54 F65 K66 F69 F117 I118	F54-F114 HydrophobicContact CE1-CD1 4.31Å; F54-F114 AromaticContact CE1-CE1 3.96Å; F54-F114 HydrophobicContact CE1-CE1 3.96Å; F54-F114 HydrophobicContact CZ-CD1 4.46Å; F65-F114 HydrophobicContact CB-CE2 4.08Å; F65-F114 HydrophobicContact CB-CZ 4.38Å; K66-F114 VanDerWaalsContact CA-CE2 3.47Å; K66-F114 HydrophobicContact CB-CE2 4.01Å; K66-F114 HydrophobicContact CB-CZ 3.71Å; K66-F114 HydrophobicContact CG-CZ 4.25Å; F69-F114 HydrophobicContact CB-CD2 3.73Å; F69-F114 HydrophobicContact CB-CE2 4.08Å; F69-F114 HydrophobicContact CD1-CB 4.37Å; F69-F114 HydrophobicContact CD1-CD2 4.26Å; F69-F114 HydrophobicContact CD2-CB 4.3Å; F69-F114 AromaticContact CD2-CD2 3.92Å; F69-F114 HydrophobicContact CD2-CD2 3.92Å; F69-F114 HydrophobicContact CE1-CB 4.33Å; F69-F114 HydrophobicContact CE2-CB 4.24Å; F69-F114 HydrophobicContact CG-CB 4.37Å; F69-F114 AromaticContact CG-CD2 3.69Å; F69-F114 HydrophobicContact CG-CD2 3.69Å; F69-F114 HydrophobicContact CG-CG 4.49Å; F69-F114 HydrophobicContact CZ-CB 4.26Å; F114-F117 WeakPolarHBondContact O-CB 3.37Å; F114-F117 PolarHBondContact O-N 2.96Å; F114-I118 HydrophobicContact CD1-CD1 4.09Å; F114-I118 HydrophobicContact CD2-CD1 4.42Å; F114-I118 HydrophobicContact CD2-CG1 4.45Å; F114-I118 HydrophobicContact CE1-CD1 3.49Å; F114-I118 VanDerWaalsContact CE1-CD1 3.49Å; F114-I118 HydrophobicContact CE1-CG1 4.47Å; F114-I118 HydrophobicContact CE2-CD1 3.84Å; F114-I118 HydrophobicContact CE2-CG1 4.03Å; F114-I118 HydrophobicContact CZ-CD1 3.37Å; F114-I118 HydrophobicContact CZ-CG1 4.07Å; F114-I118 WeakPolarHBondContact O-CG1 3.42Å; F114-I118 PolarHBondContact O-N 3.03Å
115	T	92.3	Very high	87.3	Confident	42 Å²	42	57 Å²	57	26%	0.258	31%	0.306	S	S	.	.	H	α-helix	trans	-70.4	-41.4	178.4	-56.7	0	0	0	0	111.2	T50 V53 F54 N113 F117 I118 N119	T50-T115 HydrophobicContact CG2-CG2 3.98Å; V53-T115 HydrophobicContact CG1-CG2 4.26Å; F54-T115 HydrophobicContact CE2-CG2 4.04Å; F54-T115 HydrophobicContact CZ-CG2 4.43Å; N113-T115 PolarHBondContact O-N 2.76Å; N113-T115 VanDerWaalsContact O-N 3.13Å; N113-T115 WeakPolarHBondContact OD1-CB 3.42Å; N113-T115 PolarHBondContact OD1-N 2.94Å; T115-F117 VanDerWaalsContact C-N 3.34Å; T115-I118 PolarHBondContact O-N 2.96Å; T115-N119 PolarHBondContact O-N 3.03Å
116	M	91.8	Very high	85.9	Confident	44 Å²	44	58.4 Å²	58.4	22%	0.217	31%	0.313	C	S	.	.	H	α-helix	trans	-66.8	-38.6	175.2	-67.1	-55.4	162.1	0	0	111.5	T50 P109 L112 N113 N119 L120	T50-M116 HydrophobicContact CG2-CE 3.53Å; T50-M116 HydrophobicContact CG2-SD 4.24Å; P109-M116 HydrophobicContact CG-SD 4.45Å; L112-M116 HydrophobicContact CD1-CB 3.93Å; N113-M116 PolarHBondContact O-N 3.3Å; N113-M116 PolarHBondContact OD1-N 3.16Å; M116-N119 WeakPolarHBondContact O-CB 3.46Å; M116-N119 PolarHBondContact O-N 3.46Å; M116-N119 VanDerWaalsContact O-N 3.15Å; M116-L120 WeakPolarHBondContact O-CG 3.42Å; M116-L120 PolarHBondContact O-N 3.15Å
117	F	91.9	Very high	84.5	Confident	15 Å²	15	56.2 Å²	56.2	7%	0.066	32%	0.317	C	S	.	.	H	α-helix	trans	-55.8	-53.5	172.9	-173.4	-99.8	0	0	0	110.8	F65 A68 F69 I72 I80 L112 N113 F114 T115 N119 L120 F121	F65-F117 HydrophobicContact CD1-CE1 4.29Å; A68-F117 HydrophobicContact CB-CZ 4.47Å; F69-F117 HydrophobicContact CB-CD1 4.35Å; F69-F117 HydrophobicContact CB-CE1 4.3Å; F69-F117 HydrophobicContact CD2-CB 3.77Å; F69-F117 AromaticContact CD2-CD1 3.98Å; F69-F117 HydrophobicContact CD2-CD1 3.98Å; F69-F117 HydrophobicContact CD2-CD2 4Å; F69-F117 AromaticContact CD2-CG 3.68Å; F69-F117 HydrophobicContact CD2-CG 3.68Å; F69-F117 HydrophobicContact CE2-CB 4.01Å; F69-F117 HydrophobicContact CE2-CG 4.32Å; I72-F117 HydrophobicContact CD1-CE2 3.89Å; I72-F117 HydrophobicContact CD1-CZ 4.07Å; I80-F117 HydrophobicContact CD1-CD2 3.8Å; I80-F117 HydrophobicContact CD1-CE2 3.9Å; L112-F117 HydrophobicContact CD1-CB 4.12Å; N113-F117 PolarHBondContact O-N 3.07Å; F114-F117 WeakPolarHBondContact O-CB 3.37Å; F114-F117 PolarHBondContact O-N 2.96Å; T115-F117 VanDerWaalsContact C-N 3.34Å; F117-N119 VanDerWaalsContact C-N 3.31Å; F117-N119 PolarHBondContact O-N 3.31Å; F117-L120 PolarHBondContact O-N 3.35Å; F117-F121 AromaticContact CD1-CD2 3.95Å; F117-F121 HydrophobicContact CD1-CD2 3.95Å; F117-F121 AromaticContact CD1-CE2 3.98Å; F117-F121 HydrophobicContact CD1-CE2 3.98Å; F117-F121 HydrophobicContact CD2-CD2 4.46Å; F117-F121 AromaticContact CD2-CE2 3.97Å; F117-F121 HydrophobicContact CD2-CE2 3.97Å; F117-F121 AromaticContact CE1-CD2 3.83Å; F117-F121 HydrophobicContact CE1-CD2 3.83Å; F117-F121 AromaticContact CE1-CE2 3.51Å; F117-F121 HydrophobicContact CE1-CE2 3.51Å; F117-F121 HydrophobicContact CE1-CZ 4.41Å; F117-F121 HydrophobicContact CE2-CD2 4.37Å; F117-F121 AromaticContact CE2-CE2 3.52Å; F117-F121 HydrophobicContact CE2-CE2 3.52Å; F117-F121 HydrophobicContact CE2-CZ 4.36Å; F117-F121 HydrophobicContact CG-CD2 4.27Å; F117-F121 HydrophobicContact CG-CE2 4.2Å; F117-F121 HydrophobicContact CZ-CD2 4.07Å; F117-F121 AromaticContact CZ-CE2 3.27Å; F117-F121 HydrophobicContact CZ-CE2 3.27Å; F117-F121 AromaticContact CZ-CZ 3.97Å; F117-F121 HydrophobicContact CZ-CZ 3.97Å; F117-F121 VanDerWaalsContact O-CD2 3.28Å; F117-F121 WeakPolarHBondContact O-CD2 3.11Å; F117-F121 PolarHBondContact O-N 3.47Å; F117-F121 VanDerWaalsContact O-N 3.1Å
118	I	89.8	Confident	83.8	Confident	0 Å²	0	53.8 Å²	53.8	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-61.1	-38.2	176.1	-65.5	174.7	0	0	0	111.7	V53 F54 F57 F65 F114 T115 L120 F121 G122	V53-I118 HydrophobicContact CB-CG2 4.43Å; V53-I118 HydrophobicContact CG1-CG2 4.08Å; V53-I118 HydrophobicContact CG2-CB 4.47Å; V53-I118 HydrophobicContact CG2-CG2 3.61Å; F54-I118 HydrophobicContact CD1-CD1 3.95Å; F54-I118 HydrophobicContact CE1-CD1 3.46Å; F54-I118 VanDerWaalsContact CE1-CD1 3.46Å; F54-I118 HydrophobicContact CZ-CD1 4.21Å; F57-I118 HydrophobicContact CD2-CG2 3.66Å; F57-I118 HydrophobicContact CE2-CG2 3.56Å; F65-I118 HydrophobicContact CB-CG1 4.22Å; F65-I118 HydrophobicContact CD2-CG1 4.47Å; F65-I118 HydrophobicContact CG-CG1 4.44Å; F114-I118 HydrophobicContact CD1-CD1 4.09Å; F114-I118 HydrophobicContact CD2-CD1 4.42Å; F114-I118 HydrophobicContact CD2-CG1 4.45Å; F114-I118 HydrophobicContact CE1-CD1 3.49Å; F114-I118 VanDerWaalsContact CE1-CD1 3.49Å; F114-I118 HydrophobicContact CE1-CG1 4.47Å; F114-I118 HydrophobicContact CE2-CD1 3.84Å; F114-I118 HydrophobicContact CE2-CG1 4.03Å; F114-I118 HydrophobicContact CZ-CD1 3.37Å; F114-I118 HydrophobicContact CZ-CG1 4.07Å; F114-I118 WeakPolarHBondContact O-CG1 3.42Å; F114-I118 PolarHBondContact O-N 3.03Å; T115-I118 PolarHBondContact O-N 2.96Å; I118-L120 PolarHBondContact O-N 3.29Å; I118-F121 CarbonylContact O-C 3.1Å; I118-F121 PolarHBondContact O-N 2.94Å; I118-G122 WeakPolarHBondContact O-CA 3.18Å; I118-G122 PolarHBondContact O-N 3.47Å
119	N	87.1	Confident	83.5	Confident	17 Å²	17	58.3 Å²	58.3	9%	0.091	33%	0.332	C	S	.	.	H	α-helix	trans	-59.6	-45.6	176.1	-76.3	-23.9	0	0	0	112	T50 V53 T115 M116 F117 F121 G122 E123	T50-N119 VanDerWaalsContact CG2-ND2 3.31Å; T50-N119 WeakPolarHBondContact CG2-ND2 3.4Å; V53-N119 WeakPolarHBondContact CB-OD1 3.31Å; V53-N119 VanDerWaalsContact CG1-OD1 3.25Å; V53-N119 WeakPolarHBondContact CG1-OD1 3.27Å; V53-N119 WeakPolarHBondContact CG2-OD1 3.36Å; T115-N119 PolarHBondContact O-N 3.03Å; M116-N119 WeakPolarHBondContact O-CB 3.46Å; M116-N119 PolarHBondContact O-N 3.46Å; M116-N119 VanDerWaalsContact O-N 3.15Å; F117-N119 VanDerWaalsContact C-N 3.31Å; F117-N119 PolarHBondContact O-N 3.31Å; N119-F121 VanDerWaalsContact C-N 3.34Å; N119-F121 PolarHBondContact O-N 2.87Å; N119-G122 CarbonylContact O-C 3.57Å; N119-G122 WeakPolarHBondContact O-CA 3.48Å; N119-G122 PolarHBondContact O-N 2.76Å; N119-E123 WeakPolarHBondContact O-CG 3.41Å; N119-E123 PolarHBondContact O-N 3.08Å
120	L	86.6	Confident	83.2	Confident	22 Å²	22	56.6 Å²	56.6	12%	0.115	32%	0.321	C	S	.	.	H	α-helix	trans	-60.8	-44.6	178	-69.6	174	0	0	0	111.3	E107 L112 M116 F117 I118 G122 E123 K124	E107-L120 HydrophobicContact CB-CD2 4.24Å; E107-L120 WeakPolarHBondContact O-CD2 3.21Å; L112-L120 HydrophobicContact CD1-CD1 3.72Å; M116-L120 WeakPolarHBondContact O-CG 3.42Å; M116-L120 PolarHBondContact O-N 3.15Å; F117-L120 PolarHBondContact O-N 3.35Å; I118-L120 PolarHBondContact O-N 3.29Å; L120-G122 VanDerWaalsContact C-N 3.3Å; L120-G122 PolarHBondContact O-N 3.43Å; L120-E123 PolarHBondContact O-N 3.35Å; L120-K124 WeakPolarHBondContact O-CB 3.47Å; L120-K124 WeakPolarHBondContact O-CG 3.48Å; L120-K124 PolarHBondContact O-N 3.05Å
121	F	81	Confident	83.1	Confident	80 Å²	80	57.5 Å²	57.5	35%	0.351	32%	0.317	S	S	.	.	H	α-helix	trans	-65.8	-34.3	172.5	-79.6	-82.1	0	0	0	112	F65 F117 I118 N119 K124 L125	F65-F121 HydrophobicContact CD1-CB 4.48Å; F65-F121 HydrophobicContact CD1-CD2 4.3Å; F65-F121 HydrophobicContact CD1-CG 4.17Å; F65-F121 HydrophobicContact CE1-CB 3.76Å; F65-F121 AromaticContact CE1-CD1 3.71Å; F65-F121 HydrophobicContact CE1-CD1 3.71Å; F65-F121 HydrophobicContact CE1-CD2 4.17Å; F65-F121 HydrophobicContact CE1-CE1 4.37Å; F65-F121 AromaticContact CE1-CG 3.59Å; F65-F121 HydrophobicContact CE1-CG 3.59Å; F65-F121 HydrophobicContact CZ-CB 3.98Å; F65-F121 HydrophobicContact CZ-CD1 4.47Å; F65-F121 HydrophobicContact CZ-CG 4.3Å; F117-F121 AromaticContact CD1-CD2 3.95Å; F117-F121 HydrophobicContact CD1-CD2 3.95Å; F117-F121 AromaticContact CD1-CE2 3.98Å; F117-F121 HydrophobicContact CD1-CE2 3.98Å; F117-F121 HydrophobicContact CD2-CD2 4.46Å; F117-F121 AromaticContact CD2-CE2 3.97Å; F117-F121 HydrophobicContact CD2-CE2 3.97Å; F117-F121 AromaticContact CE1-CD2 3.83Å; F117-F121 HydrophobicContact CE1-CD2 3.83Å; F117-F121 AromaticContact CE1-CE2 3.51Å; F117-F121 HydrophobicContact CE1-CE2 3.51Å; F117-F121 HydrophobicContact CE1-CZ 4.41Å; F117-F121 HydrophobicContact CE2-CD2 4.37Å; F117-F121 AromaticContact CE2-CE2 3.52Å; F117-F121 HydrophobicContact CE2-CE2 3.52Å; F117-F121 HydrophobicContact CE2-CZ 4.36Å; F117-F121 HydrophobicContact CG-CD2 4.27Å; F117-F121 HydrophobicContact CG-CE2 4.2Å; F117-F121 HydrophobicContact CZ-CD2 4.07Å; F117-F121 AromaticContact CZ-CE2 3.27Å; F117-F121 HydrophobicContact CZ-CE2 3.27Å; F117-F121 AromaticContact CZ-CZ 3.97Å; F117-F121 HydrophobicContact CZ-CZ 3.97Å; F117-F121 VanDerWaalsContact O-CD2 3.28Å; F117-F121 WeakPolarHBondContact O-CD2 3.11Å; F117-F121 PolarHBondContact O-N 3.47Å; F117-F121 VanDerWaalsContact O-N 3.1Å; I118-F121 CarbonylContact O-C 3.1Å; I118-F121 PolarHBondContact O-N 2.94Å; N119-F121 VanDerWaalsContact C-N 3.34Å; N119-F121 PolarHBondContact O-N 2.87Å; F121-K124 PolarHBondContact O-N 3.33Å; F121-L125 HydrophobicContact CB-CD1 4.18Å; F121-L125 HydrophobicContact CD1-CD1 4.18Å; F121-L125 WeakPolarHBondContact O-CA 3.12Å; F121-L125 WeakPolarHBondContact O-CB 3.09Å; F121-L125 WeakPolarHBondContact O-CG 3.42Å; F121-L125 PolarHBondContact O-N 2.89Å
122	G	78	Confident	83	Confident	3 Å²	3	57.8 Å²	57.8	3%	0.031	31%	0.313	C	S	.	.	H	α-helix	trans	-60.5	-49.8	174.9	0	0	0	0	0	112	F57 I118 N119 L120 N126	F57-G122 VanDerWaalsContact CZ-CA 3.46Å; I118-G122 WeakPolarHBondContact O-CA 3.18Å; I118-G122 PolarHBondContact O-N 3.47Å; N119-G122 CarbonylContact O-C 3.57Å; N119-G122 WeakPolarHBondContact O-CA 3.48Å; N119-G122 PolarHBondContact O-N 2.76Å; L120-G122 VanDerWaalsContact C-N 3.3Å; L120-G122 PolarHBondContact O-N 3.43Å; G122-N126 WeakPolarHBondContact CA-ND2 3.47Å; G122-N126 WeakPolarHBondContact O-CA 3.5Å; G122-N126 WeakPolarHBondContact O-CB 3.32Å; G122-N126 PolarHBondContact O-N 2.86Å; G122-N126 PolarHBondContact O-ND2 2.83Å; G122-N126 VanDerWaalsContact O-ND2 3.12Å
123	E	75.1	Confident	82.8	Confident	138 Å²	138	59 Å²	59	65%	0.645	33%	0.325	S	S	*	.	H	α-helix	trans	-65	-40.5	177.9	-69.8	177.3	178.8	0	0	111.2	N119 L120	N119-E123 WeakPolarHBondContact O-CG 3.41Å; N119-E123 PolarHBondContact O-N 3.08Å; L120-E123 PolarHBondContact O-N 3.35Å
124	K	70.3	Confident	82.7	Confident	136 Å²	136	57.8 Å²	57.8	59%	0.591	32%	0.319	S	S	*	.	H	α-helix	trans	-75.4	-37.3	179.4	-72.4	179.5	173.6	176.4	0	113.8	E107 L120 F121	E107-K124 IonicContact OE1-NZ 3.07Å; E107-K124 PolarHBondContact OE1-NZ 3.48Å; E107-K124 IonicContact OE2-NZ 3.38Å; E107-K124 PolarHBondContact OE2-NZ 2.64Å; L120-K124 WeakPolarHBondContact O-CB 3.47Å; L120-K124 WeakPolarHBondContact O-CG 3.48Å; L120-K124 PolarHBondContact O-N 3.05Å; F121-K124 PolarHBondContact O-N 3.33Å
125	L	65.4	Low	82.6	Confident	82 Å²	82	58.3 Å²	58.3	43%	0.429	32%	0.32	S	S	.	.	H	α-helix	trans	-91.8	-32.2	-175.9	-64.6	171.9	0	0	0	113.5	F57 F65 F121 G127	F57-L125 HydrophobicContact CE1-CB 4.38Å; F57-L125 HydrophobicContact CE1-CD1 4.08Å; F57-L125 HydrophobicContact CZ-CD1 4.35Å; F65-L125 HydrophobicContact CE1-CD1 4.32Å; F65-L125 HydrophobicContact CZ-CD1 3.73Å; F121-L125 HydrophobicContact CB-CD1 4.18Å; F121-L125 HydrophobicContact CD1-CD1 4.18Å; F121-L125 WeakPolarHBondContact O-CA 3.12Å; F121-L125 WeakPolarHBondContact O-CB 3.09Å; F121-L125 WeakPolarHBondContact O-CG 3.42Å; F121-L125 PolarHBondContact O-N 2.89Å; L125-G127 VanDerWaalsContact C-N 3.28Å; L125-G127 PolarHBondContact O-N 3.12Å
126	N	64.5	Low	82.7	Confident	63 Å²	63	61.1 Å²	61.1	34%	0.337	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.7	11.7	179.6	-57.4	-50.6	0	0	0	113.2	M56 G122 T128	M56-N126 HydrophobicContact CE-CB 3.71Å; M56-N126 WeakPolarHBondContact CE-ND2 3.37Å; G122-N126 WeakPolarHBondContact CA-ND2 3.47Å; G122-N126 WeakPolarHBondContact O-CA 3.5Å; G122-N126 WeakPolarHBondContact O-CB 3.32Å; G122-N126 PolarHBondContact O-N 2.86Å; G122-N126 PolarHBondContact O-ND2 2.83Å; G122-N126 VanDerWaalsContact O-ND2 3.12Å; N126-T128 PolarHBondContact O-N 2.92Å; N126-T128 VanDerWaalsContact O-N 3.1Å
127	G	65.4	Low	82.8	Confident	65 Å²	65	61.2 Å²	61.2	67%	0.67	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.5	-2.6	172.4	0	0	0	0	0	114.4	L125	L125-G127 VanDerWaalsContact C-N 3.28Å; L125-G127 PolarHBondContact O-N 3.12Å
128	T	74.2	Confident	82.9	Confident	51 Å²	51	62 Å²	62	31%	0.313	34%	0.344	S	S	.	.	S	Bend	trans	-130.2	142.7	-174.2	59.8	0	0	0	0	112	N126 I193 K194	N126-T128 PolarHBondContact O-N 2.92Å; N126-T128 VanDerWaalsContact O-N 3.1Å; T128-I193 HydrophobicContact CG2-CG2 3.53Å; T128-K194 PolarHBondContact O-NZ 3.4Å; T128-K194 WeakPolarHBondContact OG1-CE 3.32Å; T128-K194 PolarHBondContact OG1-NZ 2.91Å
129	D	82.3	Confident	83.1	Confident	104 Å²	104	63.6 Å²	63.6	56%	0.556	36%	0.357	S	S	*	.			trans	-60.6	156.4	178.1	-72.5	-40.6	0	0	0	112.8	A133 L134 K194	D129-A133 HydrophobicContact CB-CB 3.96Å; D129-L134 HydrophobicContact CB-CD2 3.93Å; D129-L134 HydrophobicContact CB-CG 4.04Å; D129-L134 VanDerWaalsContact O-CD1 3.29Å; D129-L134 WeakPolarHBondContact O-CD1 3.47Å; D129-L134 WeakPolarHBondContact O-CG 3.03Å; D129-K194 WeakPolarHBondContact O-CE 3.48Å; D129-K194 PolarHBondContact O-NZ 2.85Å
130	P	82.7	Confident	83.4	Confident	88 Å²	88	70.2 Å²	70.2	57%	0.571	39%	0.389	S	S	*	.			trans	-49.6	150.8	174.3	-26.7	34.4	0	0	0	113.3	D132 A133 L134	P130-D132 PolarHBondContact O-N 3.01Å; P130-D132 VanDerWaalsContact O-N 3.14Å; P130-A133 HydrophobicContact CB-CB 4.46Å; P130-A133 WeakPolarHBondContact O-CA 2.76Å; P130-A133 WeakPolarHBondContact O-CB 3.48Å; P130-A133 PolarHBondContact O-N 2.69Å; P130-L134 PolarHBondContact O-N 2.63Å
131	E	88.5	Confident	83.7	Confident	53 Å²	53	73.1 Å²	73.1	25%	0.248	40%	0.401	C	S	.	.	H	α-helix	trans	-53.8	-40.1	-175.1	-152	-175	145.8	0	0	112.8	L134 R135 V190 N191 K194	E131-L134 PolarHBondContact O-N 3.37Å; E131-R135 VanDerWaalsContact CG-NH1 3.33Å; E131-R135 WeakPolarHBondContact O-CB 3.29Å; E131-R135 WeakPolarHBondContact O-CG 3.4Å; E131-R135 PolarHBondContact O-N 3.4Å; E131-R135 IonicContact OE1-CZ 2.64Å; E131-R135 IonicContact OE1-NH1 2.97Å; E131-R135 PolarHBondContact OE1-NH1 3.14Å; E131-R135 IonicContact OE1-NH2 3.75Å; E131-V190 HydrophobicContact CB-CG1 4.28Å; E131-V190 HydrophobicContact CG-CG1 3.3Å; E131-N191 PolarHBondContact OE1-OD1 3.45Å; E131-K194 HydrophobicContact CG-CG 4.47Å
132	D	90.7	Very high	84.4	Confident	101 Å²	101	69.5 Å²	69.5	54%	0.54	39%	0.386	S	S	.	.	H	α-helix	trans	-67.3	-37	175.8	-68.5	-38.7	0	0	0	113.2	P130 R135 N136	P130-D132 PolarHBondContact O-N 3.01Å; P130-D132 VanDerWaalsContact O-N 3.14Å; D132-R135 IonicContact OD1-CZ 2.89Å; D132-R135 IonicContact OD1-NE 2.7Å; D132-R135 PolarHBondContact OD1-NE 2.89Å; D132-R135 IonicContact OD1-NH2 3.6Å; D132-R135 PolarHBondContact OD1-NH2 3.46Å; D132-N136 VanDerWaalsContact O-CB 3.23Å; D132-N136 WeakPolarHBondContact O-CB 3.27Å; D132-N136 PolarHBondContact O-N 3.03Å; D132-N136 PolarHBondContact O-ND2 3.26Å
133	A	91.2	Very high	85	Confident	43 Å²	43	75.7 Å²	75.7	36%	0.355	43%	0.425	S	S	.	.	H	α-helix	trans	-67.7	-43.5	177.2	0	0	0	0	0	110.7	D129 P130 N136 A137	D129-A133 HydrophobicContact CB-CB 3.96Å; P130-A133 HydrophobicContact CB-CB 4.46Å; P130-A133 WeakPolarHBondContact O-CA 2.76Å; P130-A133 WeakPolarHBondContact O-CB 3.48Å; P130-A133 PolarHBondContact O-N 2.69Å; A133-N136 PolarHBondContact O-N 2.89Å; A133-A137 PolarHBondContact O-N 2.72Å
134	L	92.6	Very high	85.9	Confident	23 Å²	23	71.7 Å²	71.7	12%	0.12	42%	0.421	C	S	.	.	H	α-helix	trans	-62.6	-46.6	174.6	-63.8	173	0	0	0	111.7	D129 P130 E131 N136 A137 F138 V190 I193 K194	D129-L134 HydrophobicContact CB-CD2 3.93Å; D129-L134 HydrophobicContact CB-CG 4.04Å; D129-L134 VanDerWaalsContact O-CD1 3.29Å; D129-L134 WeakPolarHBondContact O-CD1 3.47Å; D129-L134 WeakPolarHBondContact O-CG 3.03Å; P130-L134 PolarHBondContact O-N 2.63Å; E131-L134 PolarHBondContact O-N 3.37Å; L134-N136 VanDerWaalsContact C-N 3.33Å; L134-N136 PolarHBondContact O-N 2.8Å; L134-A137 WeakPolarHBondContact O-CB 3.4Å; L134-A137 PolarHBondContact O-N 2.76Å; L134-F138 VanDerWaalsContact O-CD2 3.24Å; L134-F138 WeakPolarHBondContact O-CD2 3.47Å; L134-F138 PolarHBondContact O-N 3.1Å; L134-V190 HydrophobicContact CB-CG1 4.03Å; L134-V190 HydrophobicContact CB-CG2 3.7Å; L134-V190 HydrophobicContact CD1-CG1 4.21Å; L134-I193 HydrophobicContact CD1-CG2 3.94Å; L134-K194 HydrophobicContact CD1-CD 4.47Å; L134-K194 HydrophobicContact CD1-CG 4.27Å
135	R	93.8	Very high	87	Confident	55 Å²	55	70.3 Å²	70.3	21%	0.208	42%	0.42	C	S	.	.	H	α-helix	trans	-57.2	-46.1	174.3	-85.5	-169.8	-76.3	-92.4	-1.4	112.2	E131 D132 A137 F138 A139 D187 V190	E131-R135 VanDerWaalsContact CG-NH1 3.33Å; E131-R135 WeakPolarHBondContact O-CB 3.29Å; E131-R135 WeakPolarHBondContact O-CG 3.4Å; E131-R135 PolarHBondContact O-N 3.4Å; E131-R135 IonicContact OE1-CZ 2.64Å; E131-R135 IonicContact OE1-NH1 2.97Å; E131-R135 PolarHBondContact OE1-NH1 3.14Å; E131-R135 IonicContact OE1-NH2 3.75Å; D132-R135 IonicContact OD1-CZ 2.89Å; D132-R135 IonicContact OD1-NE 2.7Å; D132-R135 PolarHBondContact OD1-NE 2.89Å; D132-R135 IonicContact OD1-NH2 3.6Å; D132-R135 PolarHBondContact OD1-NH2 3.46Å; R135-A137 VanDerWaalsContact C-N 3.28Å; R135-A137 PolarHBondContact O-N 3.18Å; R135-F138 PolarHBondContact O-N 3.2Å; R135-A139 WeakPolarHBondContact O-CB 3.44Å; R135-A139 PolarHBondContact O-N 2.64Å; R135-D187 VanDerWaalsContact CD-OD1 3.32Å; R135-D187 WeakPolarHBondContact CD-OD1 3.35Å; R135-V190 HydrophobicContact CG-CB 4.5Å; R135-V190 HydrophobicContact CG-CG1 4.36Å; R135-V190 HydrophobicContact CG-CG2 4.23Å
136	N	93.8	Very high	88.4	Confident	100 Å²	100	71 Å²	71	54%	0.535	42%	0.42	S	S	.	.	H	α-helix	trans	-63.8	-36.4	179.9	-72.8	-24.7	0	0	0	111.4	D132 A133 L134 A139 M140	D132-N136 VanDerWaalsContact O-CB 3.23Å; D132-N136 WeakPolarHBondContact O-CB 3.27Å; D132-N136 PolarHBondContact O-N 3.03Å; D132-N136 PolarHBondContact O-ND2 3.26Å; A133-N136 PolarHBondContact O-N 2.89Å; L134-N136 VanDerWaalsContact C-N 3.33Å; L134-N136 PolarHBondContact O-N 2.8Å; N136-A139 PolarHBondContact O-N 2.89Å; N136-M140 WeakPolarHBondContact O-CG 3.35Å; N136-M140 PolarHBondContact O-N 3.34Å; N136-M140 VanDerWaalsContact O-N 3.14Å
137	A	93	Very high	89.9	Confident	46 Å²	46	73.8 Å²	73.8	38%	0.38	43%	0.425	S	S	.	.	H	α-helix	trans	-60.9	-45.6	175.3	0	0	0	0	0	111.9	A133 L134 R135 M140 F141	A133-A137 PolarHBondContact O-N 2.72Å; L134-A137 WeakPolarHBondContact O-CB 3.4Å; L134-A137 PolarHBondContact O-N 2.76Å; R135-A137 VanDerWaalsContact C-N 3.28Å; R135-A137 PolarHBondContact O-N 3.18Å; A137-M140 WeakPolarHBondContact O-CB 3.18Å; A137-M140 PolarHBondContact O-N 3.5Å; A137-F141 WeakPolarHBondContact O-CD2 3.32Å
138	F	94.6	Very high	91.3	Very high	33 Å²	33	73.8 Å²	73.8	15%	0.145	41%	0.406	C	S	.	.	H	α-helix	trans	-65.9	-40.5	173.9	-72.3	-68.5	0	0	0	112.6	L134 R135 M140 F141 L149 I154 Y186 F189 V190	L134-F138 VanDerWaalsContact O-CD2 3.24Å; L134-F138 WeakPolarHBondContact O-CD2 3.47Å; L134-F138 PolarHBondContact O-N 3.1Å; R135-F138 PolarHBondContact O-N 3.2Å; F138-M140 PolarHBondContact O-N 3.26Å; F138-F141 PolarHBondContact O-N 3.34Å; F138-L149 HydrophobicContact CD1-CD1 3.95Å; F138-I154 HydrophobicContact CD1-CD1 4.08Å; F138-I154 HydrophobicContact CE1-CD1 3.59Å; F138-Y186 HydrophobicContact CB-CD1 3.97Å; F138-Y186 HydrophobicContact CB-CD2 3.6Å; F138-Y186 HydrophobicContact CB-CE1 4.44Å; F138-Y186 HydrophobicContact CB-CE2 4.14Å; F138-Y186 HydrophobicContact CB-CG 3.5Å; F138-Y186 HydrophobicContact CD2-CD2 4.43Å; F138-Y186 HydrophobicContact CD2-CG 4.4Å; F138-Y186 HydrophobicContact CG-CD2 4.23Å; F138-Y186 AromaticContact CG-CG 3.93Å; F138-Y186 HydrophobicContact CG-CG 3.93Å; F138-F189 HydrophobicContact CE1-CD1 4.42Å; F138-F189 AromaticContact CE2-CD1 4Å; F138-F189 HydrophobicContact CE2-CD1 4Å; F138-F189 AromaticContact CZ-CD1 3.53Å; F138-F189 HydrophobicContact CZ-CD1 3.53Å; F138-F189 AromaticContact CZ-CE1 3.89Å; F138-F189 HydrophobicContact CZ-CE1 3.89Å; F138-V190 HydrophobicContact CD2-CG2 3.84Å; F138-V190 HydrophobicContact CE2-CG2 3.83Å
139	A	94.6	Very high	92.4	Very high	33 Å²	33	71.5 Å²	71.5	27%	0.273	39%	0.392	S	S	.	.	H	α-helix	trans	-61.4	-24.5	179.5	0	0	0	0	0	113.3	R135 N136 F141 D142	R135-A139 WeakPolarHBondContact O-CB 3.44Å; R135-A139 PolarHBondContact O-N 2.64Å; N136-A139 PolarHBondContact O-N 2.89Å; A139-F141 PolarHBondContact O-N 3.44Å; A139-D142 CarbonylContact O-C 3.46Å; A139-D142 PolarHBondContact O-N 2.97Å; A139-D142 VanDerWaalsContact O-N 3.11Å
140	M	93.8	Very high	93	Very high	155 Å²	155	70.3 Å²	70.3	76%	0.764	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-27.3	172.9	-68.1	-176.3	-172.3	0	0	112.9	N136 A137 F138	N136-M140 WeakPolarHBondContact O-CG 3.35Å; N136-M140 PolarHBondContact O-N 3.34Å; N136-M140 VanDerWaalsContact O-N 3.14Å; A137-M140 WeakPolarHBondContact O-CB 3.18Å; A137-M140 PolarHBondContact O-N 3.5Å; F138-M140 PolarHBondContact O-N 3.26Å
141	F	92.8	Very high	93.6	Very high	83 Å²	83	69.1 Å²	69.1	36%	0.364	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.4	-3.8	178.4	-58.4	-76.9	0	0	0	113	A137 F138 A139 P143 L149 Y153 L157	A137-F141 WeakPolarHBondContact O-CD2 3.32Å; F138-F141 PolarHBondContact O-N 3.34Å; A139-F141 PolarHBondContact O-N 3.44Å; F141-P143 VanDerWaalsContact C-CD 3.44Å; F141-P143 WeakPolarHBondContact O-CD 3.31Å; F141-L149 HydrophobicContact CB-CD1 4.05Å; F141-L149 HydrophobicContact CB-CD2 3.9Å; F141-L149 WeakPolarHBondContact O-CD2 3.23Å; F141-Y153 HydrophobicContact CB-CE1 4.04Å; F141-L157 HydrophobicContact CB-CD1 4.28Å; F141-L157 HydrophobicContact CD1-CD1 3.59Å; F141-L157 HydrophobicContact CD1-CD2 4.15Å; F141-L157 HydrophobicContact CD2-CD1 4.24Å; F141-L157 HydrophobicContact CE1-CD1 3.89Å; F141-L157 HydrophobicContact CE1-CD2 3.92Å; F141-L157 HydrophobicContact CG-CD1 3.78Å; F141-L157 HydrophobicContact CZ-CD1 4.34Å
142	D	94.8	Very high	93.8	Very high	4 Å²	4	74.6 Å²	74.6	2%	0.021	40%	0.395	C	S	.	.			trans	-120.2	71.8	177.6	-176.2	17.6	0	0	0	111	A139 G144 N145 K146 R147 L149 Y186	A139-D142 CarbonylContact O-C 3.46Å; A139-D142 PolarHBondContact O-N 2.97Å; A139-D142 VanDerWaalsContact O-N 3.11Å; D142-G144 PolarHBondContact O-N 3.35Å; D142-G144 PolarHBondContact OD1-N 3.02Å; D142-N145 PolarHBondContact O-N 2.92Å; D142-N145 PolarHBondContact OD1-N 2.92Å; D142-K146 VanDerWaalsContact CG-N 3.34Å; D142-K146 WeakPolarHBondContact OD1-CE 3.42Å; D142-K146 PolarHBondContact OD1-N 3.49Å; D142-K146 WeakPolarHBondContact OD2-CA 3.46Å; D142-K146 PolarHBondContact OD2-N 3.2Å; D142-R147 PolarHBondContact OD2-N 3.21Å; D142-L149 HydrophobicContact CB-CD2 3.88Å; D142-Y186 HydrophobicContact CB-CE1 4.14Å
143	P	91.8	Very high	94	Very high	133 Å²	133	74.3 Å²	74.3	86%	0.864	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.3	-16.5	179.8	26.6	-35.7	0	0	0	113.3	F141 N145	F141-P143 VanDerWaalsContact C-CD 3.44Å; F141-P143 WeakPolarHBondContact O-CD 3.31Å; P143-N145 VanDerWaalsContact C-N 3.34Å
144	G	93.4	Very high	94.1	Very high	54 Å²	54	72.6 Å²	72.6	56%	0.557	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84	-5.6	175.1	0	0	0	0	0	114.1	D142 K146	D142-G144 PolarHBondContact O-N 3.35Å; D142-G144 PolarHBondContact OD1-N 3.02Å; G144-K146 PolarHBondContact O-N 2.88Å
145	N	92.9	Very high	94.2	Very high	108 Å²	108	75.7 Å²	75.7	58%	0.578	38%	0.384	S	S	*	.			trans	47.5	40.7	-173.9	-169.1	37.3	0	0	0	112.4	D142 P143 R147	D142-N145 PolarHBondContact O-N 2.92Å; D142-N145 PolarHBondContact OD1-N 2.92Å; P143-N145 VanDerWaalsContact C-N 3.34Å; N145-R147 PolarHBondContact O-N 3.42Å
146	K	95.4	Very high	94.2	Very high	96 Å²	96	76.7 Å²	76.7	42%	0.417	39%	0.394	S	S	.	.			trans	-70.9	-17.3	177.8	-59.2	175.7	-68.3	169.3	0	112	D142 G144 Y148	D142-K146 VanDerWaalsContact CG-N 3.34Å; D142-K146 WeakPolarHBondContact OD1-CE 3.42Å; D142-K146 PolarHBondContact OD1-N 3.49Å; D142-K146 WeakPolarHBondContact OD2-CA 3.46Å; D142-K146 PolarHBondContact OD2-N 3.2Å; G144-K146 PolarHBondContact O-N 2.88Å; K146-Y148 HydrophobicContact CB-CD1 3.78Å; K146-Y148 HydrophobicContact CB-CE1 3.56Å; K146-Y148 HydrophobicContact CB-CG 4.36Å; K146-Y148 HydrophobicContact CD-CE1 4.3Å; K146-Y148 HydrophobicContact CD-CE2 4.2Å; K146-Y148 HydrophobicContact CG-CE1 4.38Å; K146-Y148 VanDerWaalsContact O-CD1 3.3Å; K146-Y148 WeakPolarHBondContact O-CD1 3.24Å; K146-Y148 PolarHBondContact O-N 3.34Å
147	R	94.7	Very high	94.1	Very high	121 Å²	121	72.5 Å²	72.5	46%	0.457	37%	0.371	S	S	.	.	S	Bend	trans	69.2	19.3	-176	-48.5	-174.8	73.2	87.2	-4.6	114.3	D142 N145 Y186 D187	D142-R147 PolarHBondContact OD2-N 3.21Å; N145-R147 PolarHBondContact O-N 3.42Å; R147-Y186 VanDerWaalsContact CA-CE1 3.44Å; R147-Y186 VanDerWaalsContact CA-CZ 3.49Å; R147-Y186 WeakPolarHBondContact CA-OH 3.41Å; R147-D187 IonicContact CZ-OD1 3.34Å; R147-D187 IonicContact CZ-OD2 2.64Å; R147-D187 IonicContact NE-OD2 3.93Å; R147-D187 PolarHBondContact NE-OD2 3.14Å; R147-D187 IonicContact NH2-OD1 3.76Å; R147-D187 PolarHBondContact NH2-OD1 3.05Å; R147-D187 IonicContact NH2-OD2 3.43Å; R147-D187 PolarHBondContact NH2-OD2 2.88Å
148	Y	96.1	Very high	94.1	Very high	66 Å²	66	72.5 Å²	72.5	26%	0.259	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.4	153.4	173.4	66.9	-99.6	0	0	0	111.3	K146 E150 K183 L184	K146-Y148 HydrophobicContact CB-CD1 3.78Å; K146-Y148 HydrophobicContact CB-CE1 3.56Å; K146-Y148 HydrophobicContact CB-CG 4.36Å; K146-Y148 HydrophobicContact CD-CE1 4.3Å; K146-Y148 HydrophobicContact CD-CE2 4.2Å; K146-Y148 HydrophobicContact CG-CE1 4.38Å; K146-Y148 VanDerWaalsContact O-CD1 3.3Å; K146-Y148 WeakPolarHBondContact O-CD1 3.24Å; K146-Y148 PolarHBondContact O-N 3.34Å; Y148-E150 WeakPolarHBondContact CE2-OE1 3.43Å; Y148-K183 HydrophobicContact CD1-CD 4.48Å; Y148-K183 HydrophobicContact CD2-CB 3.88Å; Y148-K183 HydrophobicContact CD2-CD 3.62Å; Y148-K183 HydrophobicContact CD2-CG 3.69Å; Y148-K183 HydrophobicContact CE1-CD 4.36Å; Y148-K183 HydrophobicContact CE2-CD 3.51Å; Y148-K183 HydrophobicContact CE2-CG 3.9Å; Y148-K183 HydrophobicContact CG-CB 4.2Å; Y148-K183 HydrophobicContact CG-CD 4.13Å; Y148-K183 HydrophobicContact CG-CG 4.39Å; Y148-K183 PolarHBondContact OH-NZ 2.96Å; Y148-L184 WeakPolarHBondContact CA-O 3.49Å; Y148-L184 WeakPolarHBondContact CB-O 3.16Å
149	L	96	Very high	94.1	Very high	3 Å²	3	74 Å²	74	2%	0.016	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	145.1	169.2	-65.5	174.9	0	0	0	109.5	F138 F141 D142 Y153 I154 K183 L184 Y186	F138-L149 HydrophobicContact CD1-CD1 3.95Å; F141-L149 HydrophobicContact CB-CD1 4.05Å; F141-L149 HydrophobicContact CB-CD2 3.9Å; F141-L149 WeakPolarHBondContact O-CD2 3.23Å; D142-L149 HydrophobicContact CB-CD2 3.88Å; L149-Y153 HydrophobicContact CD2-CD1 4.29Å; L149-Y153 HydrophobicContact CD2-CE1 4.28Å; L149-I154 HydrophobicContact CB-CB 4.46Å; L149-I154 HydrophobicContact CD1-CD1 4Å; L149-K183 CarbonylContact O-C 3.59Å; L149-K183 WeakPolarHBondContact O-CA 3.43Å; L149-L184 PolarHBondContact N-O 3.2Å; L149-L184 VanDerWaalsContact N-O 3.09Å; L149-L184 PolarHBondContact O-N 3.41Å; L149-Y186 HydrophobicContact CG-CD1 4.22Å
150	E	96.1	Very high	93.9	Very high	78 Å²	78	77.3 Å²	77.3	36%	0.364	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65	136.2	173.9	-57.9	-62.5	160.9	0	0	109.1	Y148 E152 Y153 I154	Y148-E150 WeakPolarHBondContact CE2-OE1 3.43Å; E150-E152 VanDerWaalsContact C-N 3.34Å; E150-E152 PolarHBondContact O-N 3.03Å; E150-Y153 WeakPolarHBondContact O-CB 3.31Å; E150-Y153 PolarHBondContact O-N 2.95Å; E150-I154 PolarHBondContact O-N 3.44Å
151	E	94.6	Very high	93.6	Very high	63 Å²	63	75.2 Å²	75.2	29%	0.294	38%	0.375	S	S	.	.	H	α-helix	trans	-56.6	-46.8	-174.1	-179.4	-176.5	168.2	0	0	112.1	Y153 I154 K155 W174 I179 G182	E151-Y153 VanDerWaalsContact C-N 3.27Å; E151-Y153 PolarHBondContact O-N 2.89Å; E151-I154 VanDerWaalsContact O-CG2 3.26Å; E151-I154 WeakPolarHBondContact O-CG2 3.4Å; E151-I154 PolarHBondContact O-N 2.71Å; E151-K155 VanDerWaalsContact O-CB 3.28Å; E151-K155 WeakPolarHBondContact O-CB 3.04Å; E151-K155 PolarHBondContact O-N 3.05Å; E151-W174 HydrophobicContact CG-CZ2 4.32Å; E151-W174 VanDerWaalsContact OE1-CD1 3.26Å; E151-W174 PolarHBondContact OE1-NE1 3.31Å; E151-I179 HydrophobicContact CB-CG2 4.48Å; E151-I179 HydrophobicContact CG-CD1 4.18Å; E151-I179 HydrophobicContact CG-CG2 4.46Å; E151-G182 WeakPolarHBondContact CB-O 3.43Å; E151-G182 PolarHBondContact N-O 3.11Å
152	E	94.1	Very high	93.3	Very high	168 Å²	168	74.4 Å²	74.4	79%	0.785	39%	0.39	S	S	*	.	H	α-helix	trans	-64	-35.5	178.2	-64	-172.4	160.1	0	0	111.7	E150 D156	E150-E152 VanDerWaalsContact C-N 3.34Å; E150-E152 PolarHBondContact O-N 3.03Å; E152-D156 WeakPolarHBondContact O-CB 3.48Å; E152-D156 PolarHBondContact O-N 3.29Å
153	Y	94.4	Very high	93	Very high	96 Å²	96	81.7 Å²	81.7	38%	0.376	43%	0.429	S	S	.	.	H	α-helix	trans	-68.4	-48.5	179.4	177.9	-131	0	0	0	111.3	F141 L149 E150 E151 K155 D156 L157	F141-Y153 HydrophobicContact CB-CE1 4.04Å; L149-Y153 HydrophobicContact CD2-CD1 4.29Å; L149-Y153 HydrophobicContact CD2-CE1 4.28Å; E150-Y153 WeakPolarHBondContact O-CB 3.31Å; E150-Y153 PolarHBondContact O-N 2.95Å; E151-Y153 VanDerWaalsContact C-N 3.27Å; E151-Y153 PolarHBondContact O-N 2.89Å; Y153-K155 VanDerWaalsContact C-N 3.32Å; Y153-K155 PolarHBondContact O-N 3.25Å; Y153-D156 WeakPolarHBondContact O-CB 3.36Å; Y153-D156 PolarHBondContact O-N 2.7Å; Y153-L157 HydrophobicContact CD1-CD1 4.33Å; Y153-L157 HydrophobicContact CD2-CG 4.32Å; Y153-L157 HydrophobicContact CE1-CD1 3.94Å; Y153-L157 HydrophobicContact CE2-CD1 4.18Å; Y153-L157 HydrophobicContact CE2-CD2 3.92Å; Y153-L157 HydrophobicContact CE2-CG 4.01Å; Y153-L157 WeakPolarHBondContact O-CG 3.48Å; Y153-L157 PolarHBondContact O-N 3.4Å
154	I	93.4	Very high	93	Very high	7 Å²	7	79.8 Å²	79.8	4%	0.036	41%	0.412	C	S	.	.	H	α-helix	trans	-67.9	-33.3	178.2	-172.9	153	0	0	0	112.6	F138 L149 E150 E151 D156 L157 L158 W174 L184	F138-I154 HydrophobicContact CD1-CD1 4.08Å; F138-I154 HydrophobicContact CE1-CD1 3.59Å; L149-I154 HydrophobicContact CB-CB 4.46Å; L149-I154 HydrophobicContact CD1-CD1 4Å; E150-I154 PolarHBondContact O-N 3.44Å; E151-I154 VanDerWaalsContact O-CG2 3.26Å; E151-I154 WeakPolarHBondContact O-CG2 3.4Å; E151-I154 PolarHBondContact O-N 2.71Å; I154-D156 VanDerWaalsContact C-N 3.35Å; I154-L157 PolarHBondContact O-N 3.21Å; I154-L158 HydrophobicContact CG1-CD1 4.32Å; I154-L158 HydrophobicContact CG1-CG 4.39Å; I154-L158 WeakPolarHBondContact O-CG 3.4Å; I154-L158 PolarHBondContact O-N 2.89Å; I154-W174 HydrophobicContact CG2-CH2 4.09Å; I154-W174 HydrophobicContact CG2-CZ2 3.83Å; I154-L184 HydrophobicContact CD1-CD2 3.33Å; I154-L184 HydrophobicContact CG1-CD2 4.45Å; I154-L184 HydrophobicContact CG2-CD2 4.42Å
155	K	93.2	Very high	92.9	Very high	87 Å²	87	80.6 Å²	80.6	38%	0.378	40%	0.4	S	S	.	.	H	α-helix	trans	-61	-44.9	172.1	-177.2	178.5	174.8	-176	0	111.4	E151 Y153 L158 Q159 I170 W174	E151-K155 VanDerWaalsContact O-CB 3.28Å; E151-K155 WeakPolarHBondContact O-CB 3.04Å; E151-K155 PolarHBondContact O-N 3.05Å; Y153-K155 VanDerWaalsContact C-N 3.32Å; Y153-K155 PolarHBondContact O-N 3.25Å; K155-L158 PolarHBondContact O-N 2.92Å; K155-Q159 WeakPolarHBondContact O-CB 3.48Å; K155-Q159 VanDerWaalsContact O-CG 3.3Å; K155-Q159 WeakPolarHBondContact O-CG 3.36Å; K155-Q159 PolarHBondContact O-N 3.3Å; K155-I170 HydrophobicContact CD-CG2 4.33Å; K155-I170 HydrophobicContact CG-CG2 4.12Å; K155-W174 HydrophobicContact CB-CH2 4.06Å; K155-W174 HydrophobicContact CB-CZ2 3.8Å
156	D	93.9	Very high	92.9	Very high	76 Å²	76	78 Å²	78	41%	0.406	39%	0.39	S	S	.	.	H	α-helix	trans	-61	-45.3	175.3	-175.8	67.3	0	0	0	111.6	E152 Y153 I154 L158 Q159 N160	E152-D156 WeakPolarHBondContact O-CB 3.48Å; E152-D156 PolarHBondContact O-N 3.29Å; Y153-D156 WeakPolarHBondContact O-CB 3.36Å; Y153-D156 PolarHBondContact O-N 2.7Å; I154-D156 VanDerWaalsContact C-N 3.35Å; D156-L158 PolarHBondContact O-N 3.44Å; D156-Q159 PolarHBondContact O-N 3.43Å; D156-N160 VanDerWaalsContact O-CB 3.3Å; D156-N160 WeakPolarHBondContact O-CB 3.3Å; D156-N160 PolarHBondContact O-N 3.41Å; D156-N160 PolarHBondContact O-ND2 3.14Å; D156-N160 PolarHBondContact OD1-ND2 3.43Å
157	L	92.7	Very high	92.7	Very high	12 Å²	12	77 Å²	77	6%	0.063	40%	0.4	C	S	.	.	H	α-helix	trans	-56.8	-50.5	175.8	-67.1	177.5	0	0	0	111.7	F141 Y153 I154 Q159 N160 M161	F141-L157 HydrophobicContact CB-CD1 4.28Å; F141-L157 HydrophobicContact CD1-CD1 3.59Å; F141-L157 HydrophobicContact CD1-CD2 4.15Å; F141-L157 HydrophobicContact CD2-CD1 4.24Å; F141-L157 HydrophobicContact CE1-CD1 3.89Å; F141-L157 HydrophobicContact CE1-CD2 3.92Å; F141-L157 HydrophobicContact CG-CD1 3.78Å; F141-L157 HydrophobicContact CZ-CD1 4.34Å; Y153-L157 HydrophobicContact CD1-CD1 4.33Å; Y153-L157 HydrophobicContact CD2-CG 4.32Å; Y153-L157 HydrophobicContact CE1-CD1 3.94Å; Y153-L157 HydrophobicContact CE2-CD1 4.18Å; Y153-L157 HydrophobicContact CE2-CD2 3.92Å; Y153-L157 HydrophobicContact CE2-CG 4.01Å; Y153-L157 WeakPolarHBondContact O-CG 3.48Å; Y153-L157 PolarHBondContact O-N 3.4Å; I154-L157 PolarHBondContact O-N 3.21Å; L157-Q159 VanDerWaalsContact C-N 3.3Å; L157-Q159 PolarHBondContact O-N 3.06Å; L157-N160 PolarHBondContact O-N 2.8Å; L157-M161 HydrophobicContact CD2-CE 3.5Å; L157-M161 VanDerWaalsContact CD2-CE 3.5Å; L157-M161 HydrophobicContact CD2-CG 4.24Å; L157-M161 HydrophobicContact CD2-SD 3.4Å; L157-M161 WeakPolarHBondContact CD2-SD 3.37Å; L157-M161 WeakPolarHBondContact O-CA 3.4Å; L157-M161 VanDerWaalsContact O-CB 3.32Å; L157-M161 WeakPolarHBondContact O-CB 3.29Å; L157-M161 PolarHBondContact O-N 3.29Å
158	L	93.2	Very high	92.7	Very high	46 Å²	46	75.1 Å²	75.1	24%	0.241	40%	0.396	C	S	.	.	H	α-helix	trans	-67.6	-28.5	-178.8	-69.6	177.6	0	0	0	112.9	I154 K155 D156 N164 F165 I170 W174	I154-L158 HydrophobicContact CG1-CD1 4.32Å; I154-L158 HydrophobicContact CG1-CG 4.39Å; I154-L158 WeakPolarHBondContact O-CG 3.4Å; I154-L158 PolarHBondContact O-N 2.89Å; K155-L158 PolarHBondContact O-N 2.92Å; D156-L158 PolarHBondContact O-N 3.44Å; L158-N164 CarbonylContact O-C 3.59Å; L158-N164 WeakPolarHBondContact O-CA 3.4Å; L158-F165 HydrophobicContact CB-CB 4.33Å; L158-F165 HydrophobicContact CB-CD2 4.46Å; L158-F165 HydrophobicContact CB-CG 4.24Å; L158-F165 HydrophobicContact CD1-CD1 4.44Å; L158-F165 HydrophobicContact CD2-CD2 4.35Å; L158-F165 HydrophobicContact CD2-CE2 4.23Å; L158-F165 HydrophobicContact CD2-CZ 4.46Å; L158-F165 PolarHBondContact O-N 2.93Å; L158-I170 HydrophobicContact CB-CD1 3.64Å; L158-I170 HydrophobicContact CD1-CD1 4.06Å; L158-W174 HydrophobicContact CD1-CH2 3.75Å; L158-W174 HydrophobicContact CD1-CZ3 3.65Å
159	Q	93.6	Very high	92.4	Very high	64 Å²	64	76.5 Å²	76.5	30%	0.299	41%	0.405	S	S	.	.	H	α-helix	trans	-85.3	-24.4	179	-72.6	-173.6	-23.7	0	0	113.7	K155 D156 L157 N164 I170	K155-Q159 WeakPolarHBondContact O-CB 3.48Å; K155-Q159 VanDerWaalsContact O-CG 3.3Å; K155-Q159 WeakPolarHBondContact O-CG 3.36Å; K155-Q159 PolarHBondContact O-N 3.3Å; D156-Q159 PolarHBondContact O-N 3.43Å; L157-Q159 VanDerWaalsContact C-N 3.3Å; L157-Q159 PolarHBondContact O-N 3.06Å; Q159-N164 WeakPolarHBondContact O-CB 3.38Å; Q159-N164 VanDerWaalsContact O-CG 3.31Å; Q159-N164 PolarHBondContact O-ND2 3.33Å; Q159-I170 HydrophobicContact CG-CD1 4.03Å; Q159-I170 HydrophobicContact CG-CG1 3.84Å
160	N	92.1	Very high	92.3	Very high	103 Å²	103	76.9 Å²	76.9	55%	0.551	41%	0.407	S	S	*	.	H	α-helix	trans	-124.1	-10.4	-168.7	-64	-48.9	0	0	0	114.8	D156 L157 N164	D156-N160 VanDerWaalsContact O-CB 3.3Å; D156-N160 WeakPolarHBondContact O-CB 3.3Å; D156-N160 PolarHBondContact O-N 3.41Å; D156-N160 PolarHBondContact O-ND2 3.14Å; D156-N160 PolarHBondContact OD1-ND2 3.43Å; L157-N160 PolarHBondContact O-N 2.8Å; N160-N164 VanDerWaalsContact CA-ND2 3.35Å; N160-N164 WeakPolarHBondContact CA-ND2 3.32Å; N160-N164 PolarHBondContact N-ND2 3.04Å
161	M	86.6	Confident	92.1	Very high	111 Å²	111	79.4 Å²	79.4	55%	0.547	41%	0.413	S	S	.	.	S	Bend	trans	-118.1	127.5	179.4	-59	-163.5	-176.6	0	0	112.8	L157 N164	L157-M161 HydrophobicContact CD2-CE 3.5Å; L157-M161 VanDerWaalsContact CD2-CE 3.5Å; L157-M161 HydrophobicContact CD2-CG 4.24Å; L157-M161 HydrophobicContact CD2-SD 3.4Å; L157-M161 WeakPolarHBondContact CD2-SD 3.37Å; L157-M161 WeakPolarHBondContact O-CA 3.4Å; L157-M161 VanDerWaalsContact O-CB 3.32Å; L157-M161 WeakPolarHBondContact O-CB 3.29Å; L157-M161 PolarHBondContact O-N 3.29Å; M161-N164 PolarHBondContact N-ND2 3.37Å
162	G	87	Confident	91.9	Very high	66 Å²	66	80.4 Å²	80.4	68%	0.68	42%	0.418	S	S	*	.	S	Bend	trans	71.4	-135.5	175.8	0	0	0	0	0	112.8	N164	G162-N164 PolarHBondContact O-N 3.49Å; G162-N164 VanDerWaalsContact O-N 3.11Å; G162-N164 PolarHBondContact O-ND2 3.38Å; G162-N164 PolarHBondContact O-OD1 3.22Å
163	D	87.4	Confident	91.7	Very high	158 Å²	158	74.1 Å²	74.1	85%	0.845	39%	0.391	S	S	*	.	S	Bend	trans	-74.1	99.3	174.4	-70.1	-22.4	0	0	0	109.1	F165	D163-F165 PolarHBondContact O-N 2.78Å
164	N	91.5	Very high	91.5	Very high	93 Å²	93	71.8 Å²	71.8	50%	0.497	38%	0.382	S	S	.	.	P	Polyproline II helix	trans	-72	128.6	-170.4	-55.2	121.3	0	0	0	111.9	L158 Q159 N160 M161 G162	L158-N164 CarbonylContact O-C 3.59Å; L158-N164 WeakPolarHBondContact O-CA 3.4Å; Q159-N164 WeakPolarHBondContact O-CB 3.38Å; Q159-N164 VanDerWaalsContact O-CG 3.31Å; Q159-N164 PolarHBondContact O-ND2 3.33Å; N160-N164 VanDerWaalsContact CA-ND2 3.35Å; N160-N164 WeakPolarHBondContact CA-ND2 3.32Å; N160-N164 PolarHBondContact N-ND2 3.04Å; M161-N164 PolarHBondContact N-ND2 3.37Å; G162-N164 PolarHBondContact O-N 3.49Å; G162-N164 VanDerWaalsContact O-N 3.11Å; G162-N164 PolarHBondContact O-ND2 3.38Å; G162-N164 PolarHBondContact O-OD1 3.22Å
165	F	92.7	Very high	91.4	Very high	70 Å²	70	77.2 Å²	77.2	31%	0.307	41%	0.405	S	S	.	.	P	Polyproline II helix	trans	-72.2	130.2	173	-81.4	-137.9	0	0	0	109.6	L158 D163 E169 I170 T173	L158-F165 HydrophobicContact CB-CB 4.33Å; L158-F165 HydrophobicContact CB-CD2 4.46Å; L158-F165 HydrophobicContact CB-CG 4.24Å; L158-F165 HydrophobicContact CD1-CD1 4.44Å; L158-F165 HydrophobicContact CD2-CD2 4.35Å; L158-F165 HydrophobicContact CD2-CE2 4.23Å; L158-F165 HydrophobicContact CD2-CZ 4.46Å; L158-F165 PolarHBondContact O-N 2.93Å; D163-F165 PolarHBondContact O-N 2.78Å; F165-E169 HydrophobicContact CB-CB 4.05Å; F165-E169 HydrophobicContact CD1-CB 3.61Å; F165-E169 HydrophobicContact CE1-CB 4.31Å; F165-E169 HydrophobicContact CG-CB 4.02Å; F165-I170 HydrophobicContact CB-CD1 3.58Å; F165-I170 HydrophobicContact CB-CG1 3.79Å; F165-I170 HydrophobicContact CD1-CD1 4.05Å; F165-I170 HydrophobicContact CG-CD1 4.15Å; F165-T173 WeakPolarHBondContact CE1-OG1 3.39Å
166	S	93.3	Very high	91.1	Very high	53 Å²	53	77.8 Å²	77.8	37%	0.371	41%	0.409	S	S	.	.	P	Polyproline II helix	trans	-62.3	161.3	165.4	66.5	0	0	0	0	111.2	E168 E169 I170	S166-E168 PolarHBondContact O-N 2.64Å; S166-E168 VanDerWaalsContact O-N 3.14Å; S166-E169 VanDerWaalsContact CB-OE2 3.26Å; S166-E169 WeakPolarHBondContact CB-OE2 3.49Å; S166-E169 PolarHBondContact N-OE2 2.91Å; S166-E169 PolarHBondContact O-N 3.42Å; S166-E169 VanDerWaalsContact O-N 3.11Å; S166-E169 WeakPolarHBondContact OG-CG 3.15Å; S166-E169 PolarHBondContact OG-N 3.09Å; S166-E169 PolarHBondContact OG-OE2 3.3Å; S166-I170 WeakPolarHBondContact O-CG1 3.29Å; S166-I170 PolarHBondContact O-N 2.99Å
167	A	91.4	Very high	90.9	Very high	75 Å²	75	74.9 Å²	74.9	62%	0.62	40%	0.395	S	S	*	.	H	α-helix	trans	-57.9	-28.3	174	0	0	0	0	0	112.8	R171	A167-R171 WeakPolarHBondContact O-CB 3.03Å; A167-R171 PolarHBondContact O-N 3.5Å; A167-R171 VanDerWaalsContact O-N 3.14Å
168	E	92.8	Very high	90.9	Very high	82 Å²	82	76.1 Å²	76.1	38%	0.383	40%	0.404	S	S	.	.	H	α-helix	trans	-68.8	-49.5	174.2	-176	60	-144.4	0	0	111.4	S166 I170 R171 Q172	S166-E168 PolarHBondContact O-N 2.64Å; S166-E168 VanDerWaalsContact O-N 3.14Å; E168-I170 PolarHBondContact O-N 3.46Å; E168-R171 VanDerWaalsContact CD-CZ 3.48Å; E168-R171 WeakPolarHBondContact O-CB 3.39Å; E168-R171 PolarHBondContact O-N 3.46Å; E168-R171 VanDerWaalsContact O-N 3.11Å; E168-R171 IonicContact OE1-CZ 3.96Å; E168-R171 IonicContact OE1-NE 2.73Å; E168-R171 IonicContact OE1-NH1 2.63Å; E168-R171 IonicContact OE1-NH2 2.94Å; E168-R171 PolarHBondContact OE1-NH2 2.8Å; E168-R171 IonicContact OE2-CZ 2.69Å; E168-R171 IonicContact OE2-NH1 3.37Å; E168-R171 PolarHBondContact OE2-NH1 3.11Å; E168-R171 IonicContact OE2-NH2 2.63Å; E168-R171 PolarHBondContact OE2-NH2 3.21Å; E168-Q172 WeakPolarHBondContact O-CG 3.41Å; E168-Q172 PolarHBondContact O-N 3.11Å; E168-Q172 PolarHBondContact OE1-NE2 3.17Å
169	E	91.6	Very high	90.9	Very high	95 Å²	95	76 Å²	76	44%	0.444	40%	0.403	S	S	.	.	H	α-helix	trans	-63.8	-39.9	-179.7	-71.9	159.4	136	0	0	111.9	F165 S166 R171 Q172 T173	F165-E169 HydrophobicContact CB-CB 4.05Å; F165-E169 HydrophobicContact CD1-CB 3.61Å; F165-E169 HydrophobicContact CE1-CB 4.31Å; F165-E169 HydrophobicContact CG-CB 4.02Å; S166-E169 VanDerWaalsContact CB-OE2 3.26Å; S166-E169 WeakPolarHBondContact CB-OE2 3.49Å; S166-E169 PolarHBondContact N-OE2 2.91Å; S166-E169 PolarHBondContact O-N 3.42Å; S166-E169 VanDerWaalsContact O-N 3.11Å; S166-E169 WeakPolarHBondContact OG-CG 3.15Å; S166-E169 PolarHBondContact OG-N 3.09Å; S166-E169 PolarHBondContact OG-OE2 3.3Å; E169-R171 PolarHBondContact O-N 2.73Å; E169-Q172 PolarHBondContact O-N 2.93Å; E169-T173 VanDerWaalsContact O-CB 3.29Å; E169-T173 WeakPolarHBondContact O-CB 3.26Å; E169-T173 PolarHBondContact O-N 2.7Å; E169-T173 PolarHBondContact O-OG1 2.98Å
170	I	92.8	Very high	90.8	Very high	11 Å²	11	81.1 Å²	81.1	6%	0.056	43%	0.425	C	S	.	.	H	α-helix	trans	-58.3	-49	171	-66	-62.8	0	0	0	110.3	K155 L158 Q159 F165 S166 E168 Q172 T173 W174	K155-I170 HydrophobicContact CD-CG2 4.33Å; K155-I170 HydrophobicContact CG-CG2 4.12Å; L158-I170 HydrophobicContact CB-CD1 3.64Å; L158-I170 HydrophobicContact CD1-CD1 4.06Å; Q159-I170 HydrophobicContact CG-CD1 4.03Å; Q159-I170 HydrophobicContact CG-CG1 3.84Å; F165-I170 HydrophobicContact CB-CD1 3.58Å; F165-I170 HydrophobicContact CB-CG1 3.79Å; F165-I170 HydrophobicContact CD1-CD1 4.05Å; F165-I170 HydrophobicContact CG-CD1 4.15Å; S166-I170 WeakPolarHBondContact O-CG1 3.29Å; S166-I170 PolarHBondContact O-N 2.99Å; E168-I170 PolarHBondContact O-N 3.46Å; I170-Q172 VanDerWaalsContact C-N 3.32Å; I170-Q172 PolarHBondContact O-N 3.35Å; I170-T173 PolarHBondContact O-N 3.27Å; I170-W174 HydrophobicContact CD1-CH2 4.23Å; I170-W174 HydrophobicContact CD1-CZ3 3.82Å; I170-W174 HydrophobicContact CG2-CD2 4.28Å; I170-W174 HydrophobicContact CG2-CE3 3.91Å; I170-W174 HydrophobicContact CG2-CZ3 4.03Å; I170-W174 PolarHBondContact O-N 3.18Å
171	R	91.6	Very high	90.8	Very high	132 Å²	132	85.1 Å²	85.1	50%	0.498	44%	0.44	S	S	.	.	H	α-helix	trans	-61	-41.5	-179.1	-170.8	-178.9	73	-129.2	9.3	112	A167 E168 E169 K175	A167-R171 WeakPolarHBondContact O-CB 3.03Å; A167-R171 PolarHBondContact O-N 3.5Å; A167-R171 VanDerWaalsContact O-N 3.14Å; E168-R171 VanDerWaalsContact CD-CZ 3.48Å; E168-R171 WeakPolarHBondContact O-CB 3.39Å; E168-R171 PolarHBondContact O-N 3.46Å; E168-R171 VanDerWaalsContact O-N 3.11Å; E168-R171 IonicContact OE1-CZ 3.96Å; E168-R171 IonicContact OE1-NE 2.73Å; E168-R171 IonicContact OE1-NH1 2.63Å; E168-R171 IonicContact OE1-NH2 2.94Å; E168-R171 PolarHBondContact OE1-NH2 2.8Å; E168-R171 IonicContact OE2-CZ 2.69Å; E168-R171 IonicContact OE2-NH1 3.37Å; E168-R171 PolarHBondContact OE2-NH1 3.11Å; E168-R171 IonicContact OE2-NH2 2.63Å; E168-R171 PolarHBondContact OE2-NH2 3.21Å; E169-R171 PolarHBondContact O-N 2.73Å; R171-K175 PolarHBondContact O-N 2.74Å
172	Q	90.9	Very high	91.2	Very high	84 Å²	84	81.2 Å²	81.2	39%	0.393	43%	0.428	S	S	.	.	H	α-helix	trans	-68.5	-43	178.6	-64	-62.1	-19.8	0	0	111.5	E168 E169 I170 W174 K175	E168-Q172 WeakPolarHBondContact O-CG 3.41Å; E168-Q172 PolarHBondContact O-N 3.11Å; E168-Q172 PolarHBondContact OE1-NE2 3.17Å; E169-Q172 PolarHBondContact O-N 2.93Å; I170-Q172 VanDerWaalsContact C-N 3.32Å; I170-Q172 PolarHBondContact O-N 3.35Å; Q172-W174 VanDerWaalsContact C-N 3.27Å; Q172-W174 PolarHBondContact O-N 2.69Å; Q172-K175 PolarHBondContact O-N 3.03Å
173	T	90.3	Very high	91.6	Very high	36 Å²	36	81.2 Å²	81.2	22%	0.221	41%	0.41	C	S	.	.	H	α-helix	trans	-59.8	-39.6	179.1	-58.7	0	0	0	0	111.5	F165 E169 I170 K175 A177 F189	F165-T173 WeakPolarHBondContact CE1-OG1 3.39Å; E169-T173 VanDerWaalsContact O-CB 3.29Å; E169-T173 WeakPolarHBondContact O-CB 3.26Å; E169-T173 PolarHBondContact O-N 2.7Å; E169-T173 PolarHBondContact O-OG1 2.98Å; I170-T173 PolarHBondContact O-N 3.27Å; T173-K175 VanDerWaalsContact C-N 3.34Å; T173-K175 PolarHBondContact O-N 3.49Å; T173-A177 WeakPolarHBondContact O-CB 3.34Å; T173-A177 PolarHBondContact O-N 3.25Å; T173-F189 HydrophobicContact CG2-CE2 3.9Å; T173-F189 HydrophobicContact CG2-CZ 3.6Å
174	W	90.8	Very high	92	Very high	47 Å²	47	73.9 Å²	73.9	18%	0.178	37%	0.37	C	S	.	.	H	α-helix	trans	-75.8	-14.3	-178.5	-94.7	-118.1	0	0	0	115.2	E151 I154 K155 L158 I170 Q172 E176 I179	E151-W174 HydrophobicContact CG-CZ2 4.32Å; E151-W174 VanDerWaalsContact OE1-CD1 3.26Å; E151-W174 PolarHBondContact OE1-NE1 3.31Å; I154-W174 HydrophobicContact CG2-CH2 4.09Å; I154-W174 HydrophobicContact CG2-CZ2 3.83Å; K155-W174 HydrophobicContact CB-CH2 4.06Å; K155-W174 HydrophobicContact CB-CZ2 3.8Å; L158-W174 HydrophobicContact CD1-CH2 3.75Å; L158-W174 HydrophobicContact CD1-CZ3 3.65Å; I170-W174 HydrophobicContact CD1-CH2 4.23Å; I170-W174 HydrophobicContact CD1-CZ3 3.82Å; I170-W174 HydrophobicContact CG2-CD2 4.28Å; I170-W174 HydrophobicContact CG2-CE3 3.91Å; I170-W174 HydrophobicContact CG2-CZ3 4.03Å; I170-W174 PolarHBondContact O-N 3.18Å; Q172-W174 VanDerWaalsContact C-N 3.27Å; Q172-W174 PolarHBondContact O-N 2.69Å; W174-E176 VanDerWaalsContact C-N 3.28Å; W174-E176 PolarHBondContact O-N 3.11Å; W174-I179 HydrophobicContact CD2-CD1 4.22Å; W174-I179 HydrophobicContact CG-CD1 3.84Å
175	K	89.7	Confident	92.2	Very high	120 Å²	120	73 Å²	73	52%	0.522	37%	0.365	S	S	.	.	H	α-helix	trans	-63.1	-39.2	177.7	-76.1	176.7	-179.9	174.5	0	112	R171 Q172 T173	R171-K175 PolarHBondContact O-N 2.74Å; Q172-K175 PolarHBondContact O-N 3.03Å; T173-K175 VanDerWaalsContact C-N 3.34Å; T173-K175 PolarHBondContact O-N 3.49Å
176	E	87.1	Confident	92.3	Very high	99 Å²	99	69.8 Å²	69.8	46%	0.463	35%	0.351	S	S	.	.	H	α-helix	trans	-109.4	-7.8	-174.3	-50.3	-51.8	150.8	0	0	112.6	W174 L192 N197	W174-E176 VanDerWaalsContact C-N 3.28Å; W174-E176 PolarHBondContact O-N 3.11Å; E176-L192 HydrophobicContact CB-CD1 4.18Å; E176-L192 HydrophobicContact CB-CD2 4.01Å; E176-L192 WeakPolarHBondContact O-CD2 3.4Å; E176-N197 PolarHBondContact OE2-ND2 3.05Å
177	A	91	Very high	92.3	Very high	15 Å²	15	68.3 Å²	68.3	12%	0.124	34%	0.339	C	S	.	.	S	Bend	trans	-63.5	134.6	-178.6	0	0	0	0	0	111.2	T173 I179 L184 F189	T173-A177 WeakPolarHBondContact O-CB 3.34Å; T173-A177 PolarHBondContact O-N 3.25Å; A177-I179 HydrophobicContact CB-CD1 3.81Å; A177-I179 HydrophobicContact CB-CG1 3.94Å; A177-I179 PolarHBondContact O-N 3.45Å; A177-L184 HydrophobicContact CB-CD1 3.78Å; A177-F189 HydrophobicContact CB-CD2 4.05Å; A177-F189 HydrophobicContact CB-CE2 3.95Å
178	P	92.1	Very high	92.4	Very high	39 Å²	39	65.7 Å²	65.7	25%	0.253	32%	0.319	S	S	.	.			trans	-76.7	75.1	179.2	32.9	-34.4	0	0	0	110.6	L184 D185 F189	P178-L184 HydrophobicContact CG-CD1 4.36Å; P178-D185 HydrophobicContact CB-CB 4.44Å; P178-D185 HydrophobicContact CG-CB 4.36Å; P178-D185 VanDerWaalsContact CG-O 3.31Å; P178-D185 WeakPolarHBondContact CG-O 3.4Å; P178-D185 PolarHBondContact O-N 2.99Å; P178-F189 HydrophobicContact CG-CB 4.12Å
179	I	92.4	Very high	92.4	Very high	43 Å²	43	63.1 Å²	63.1	22%	0.221	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	125.1	179.8	-60.6	168.7	0	0	0	109.2	E151 W174 A177 K183 L184	E151-I179 HydrophobicContact CB-CG2 4.48Å; E151-I179 HydrophobicContact CG-CD1 4.18Å; E151-I179 HydrophobicContact CG-CG2 4.46Å; W174-I179 HydrophobicContact CD2-CD1 4.22Å; W174-I179 HydrophobicContact CG-CD1 3.84Å; A177-I179 HydrophobicContact CB-CD1 3.81Å; A177-I179 HydrophobicContact CB-CG1 3.94Å; A177-I179 PolarHBondContact O-N 3.45Å; I179-K183 VanDerWaalsContact CA-O 3.29Å; I179-K183 WeakPolarHBondContact CA-O 3.43Å; I179-L184 HydrophobicContact CD1-CD1 4.27Å; I179-L184 HydrophobicContact CG1-CB 4.26Å; I179-L184 HydrophobicContact CG1-CD1 3.58Å
180	K	92	Very high	92.4	Very high	172 Å²	172	58.6 Å²	58.6	75%	0.748	29%	0.286	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-130.9	130.8	173.9	-67.6	178.8	-177.8	171.5	0	109	G182 K183	K180-G182 PolarHBondContact O-N 2.81Å; K180-K183 PolarHBondContact N-O 2.95Å; K180-K183 WeakPolarHBondContact O-CB 3.48Å; K180-K183 PolarHBondContact O-N 3.41Å
181	E	92.6	Very high	92.2	Very high	187 Å²	187	60.9 Å²	60.9	87%	0.874	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.9	39.6	178.3	-55	-177.4	163.4	0	0	113.2	K183	E181-K183 VanDerWaalsContact C-N 3.28Å; E181-K183 PolarHBondContact O-N 3.44Å
182	G	94	Very high	92	Very high	29 Å²	29	56.3 Å²	56.3	30%	0.299	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.8	17.7	-178.9	0	0	0	0	0	114.5	E151 K180	E151-G182 WeakPolarHBondContact CB-O 3.43Å; E151-G182 PolarHBondContact N-O 3.11Å; K180-G182 PolarHBondContact O-N 2.81Å
183	K	95.9	Very high	91.8	Very high	66 Å²	66	55.2 Å²	55.2	29%	0.287	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	127.1	179.4	-65	169.3	179.4	179.4	0	110.8	Y148 L149 I179 K180 E181	Y148-K183 HydrophobicContact CD1-CD 4.48Å; Y148-K183 HydrophobicContact CD2-CB 3.88Å; Y148-K183 HydrophobicContact CD2-CD 3.62Å; Y148-K183 HydrophobicContact CD2-CG 3.69Å; Y148-K183 HydrophobicContact CE1-CD 4.36Å; Y148-K183 HydrophobicContact CE2-CD 3.51Å; Y148-K183 HydrophobicContact CE2-CG 3.9Å; Y148-K183 HydrophobicContact CG-CB 4.2Å; Y148-K183 HydrophobicContact CG-CD 4.13Å; Y148-K183 HydrophobicContact CG-CG 4.39Å; Y148-K183 PolarHBondContact OH-NZ 2.96Å; L149-K183 CarbonylContact O-C 3.59Å; L149-K183 WeakPolarHBondContact O-CA 3.43Å; I179-K183 VanDerWaalsContact CA-O 3.29Å; I179-K183 WeakPolarHBondContact CA-O 3.43Å; K180-K183 PolarHBondContact N-O 2.95Å; K180-K183 WeakPolarHBondContact O-CB 3.48Å; K180-K183 PolarHBondContact O-N 3.41Å; E181-K183 VanDerWaalsContact C-N 3.28Å; E181-K183 PolarHBondContact O-N 3.44Å
184	L	95.8	Very high	91.5	Very high	4 Å²	4	56.6 Å²	56.6	2%	0.021	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	118.9	172	-176.8	75.3	0	0	0	109.9	Y148 L149 I154 A177 P178 I179 Y186 F189	Y148-L184 WeakPolarHBondContact CA-O 3.49Å; Y148-L184 WeakPolarHBondContact CB-O 3.16Å; L149-L184 PolarHBondContact N-O 3.2Å; L149-L184 VanDerWaalsContact N-O 3.09Å; L149-L184 PolarHBondContact O-N 3.41Å; I154-L184 HydrophobicContact CD1-CD2 3.33Å; I154-L184 HydrophobicContact CG1-CD2 4.45Å; I154-L184 HydrophobicContact CG2-CD2 4.42Å; A177-L184 HydrophobicContact CB-CD1 3.78Å; P178-L184 HydrophobicContact CG-CD1 4.36Å; I179-L184 HydrophobicContact CD1-CD1 4.27Å; I179-L184 HydrophobicContact CG1-CB 4.26Å; I179-L184 HydrophobicContact CG1-CD1 3.58Å; L184-Y186 PolarHBondContact O-N 2.83Å; L184-F189 HydrophobicContact CD1-CB 4.3Å; L184-F189 HydrophobicContact CD1-CD2 4.06Å; L184-F189 HydrophobicContact CD1-CG 4.3Å; L184-F189 HydrophobicContact CD2-CB 4.35Å; L184-F189 HydrophobicContact CD2-CD1 4.44Å; L184-F189 HydrophobicContact CD2-CG 4.23Å; L184-F189 HydrophobicContact CG-CB 4.43Å
185	D	95.4	Very high	90.8	Very high	73 Å²	73	62.1 Å²	62.1	39%	0.39	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	100.2	163.8	174	3.7	0	0	0	109	P178 D187 G188 F189	P178-D185 HydrophobicContact CB-CB 4.44Å; P178-D185 HydrophobicContact CG-CB 4.36Å; P178-D185 VanDerWaalsContact CG-O 3.31Å; P178-D185 WeakPolarHBondContact CG-O 3.4Å; P178-D185 PolarHBondContact O-N 2.99Å; D185-D187 VanDerWaalsContact C-N 3.29Å; D185-D187 PolarHBondContact O-N 3.4Å; D185-D187 WeakPolarHBondContact OD1-CB 3.28Å; D185-D187 PolarHBondContact OD1-N 2.73Å; D185-G188 PolarHBondContact O-N 3Å; D185-G188 PolarHBondContact OD1-N 2.97Å; D185-F189 WeakPolarHBondContact O-CB 3.26Å; D185-F189 PolarHBondContact O-N 2.63Å
186	Y	94.9	Very high	89.7	Confident	4 Å²	4	58.2 Å²	58.2	2%	0.016	30%	0.298	C	S	.	.	H	α-helix	trans	-74	-18.7	-176.2	62.8	-109.1	0	0	0	113.1	F138 D142 R147 L149 L184 F189 V190	F138-Y186 HydrophobicContact CB-CD1 3.97Å; F138-Y186 HydrophobicContact CB-CD2 3.6Å; F138-Y186 HydrophobicContact CB-CE1 4.44Å; F138-Y186 HydrophobicContact CB-CE2 4.14Å; F138-Y186 HydrophobicContact CB-CG 3.5Å; F138-Y186 HydrophobicContact CD2-CD2 4.43Å; F138-Y186 HydrophobicContact CD2-CG 4.4Å; F138-Y186 HydrophobicContact CG-CD2 4.23Å; F138-Y186 AromaticContact CG-CG 3.93Å; F138-Y186 HydrophobicContact CG-CG 3.93Å; D142-Y186 HydrophobicContact CB-CE1 4.14Å; R147-Y186 VanDerWaalsContact CA-CE1 3.44Å; R147-Y186 VanDerWaalsContact CA-CZ 3.49Å; R147-Y186 WeakPolarHBondContact CA-OH 3.41Å; L149-Y186 HydrophobicContact CG-CD1 4.22Å; L184-Y186 PolarHBondContact O-N 2.83Å; Y186-F189 PolarHBondContact O-N 2.78Å; Y186-V190 WeakPolarHBondContact O-CB 3.38Å; Y186-V190 WeakPolarHBondContact O-CG2 3.4Å; Y186-V190 PolarHBondContact O-N 3.03Å
187	D	93.1	Very high	88.4	Confident	21 Å²	21	57 Å²	57	11%	0.112	29%	0.294	C	S	.	.	H	α-helix	trans	-71.9	-43.4	170.7	-66	-58.4	0	0	0	110.7	R135 R147 D185 F189 V190 N191	R135-D187 VanDerWaalsContact CD-OD1 3.32Å; R135-D187 WeakPolarHBondContact CD-OD1 3.35Å; R147-D187 IonicContact CZ-OD1 3.34Å; R147-D187 IonicContact CZ-OD2 2.64Å; R147-D187 IonicContact NE-OD2 3.93Å; R147-D187 PolarHBondContact NE-OD2 3.14Å; R147-D187 IonicContact NH2-OD1 3.76Å; R147-D187 PolarHBondContact NH2-OD1 3.05Å; R147-D187 IonicContact NH2-OD2 3.43Å; R147-D187 PolarHBondContact NH2-OD2 2.88Å; D185-D187 VanDerWaalsContact C-N 3.29Å; D185-D187 PolarHBondContact O-N 3.4Å; D185-D187 WeakPolarHBondContact OD1-CB 3.28Å; D185-D187 PolarHBondContact OD1-N 2.73Å; D187-F189 PolarHBondContact O-N 3.48Å; D187-V190 PolarHBondContact O-N 2.98Å; D187-N191 PolarHBondContact O-N 3.14Å; D187-N191 PolarHBondContact O-ND2 3.34Å
188	G	92.7	Very high	86.3	Confident	20 Å²	20	63.5 Å²	63.5	21%	0.206	32%	0.322	C	S	.	.	H	α-helix	trans	-56.9	-42.4	169.7	0	0	0	0	0	111.2	D185 N191 L192	D185-G188 PolarHBondContact O-N 3Å; D185-G188 PolarHBondContact OD1-N 2.97Å; G188-N191 WeakPolarHBondContact O-CB 3.3Å; G188-N191 PolarHBondContact O-N 3.24Å; G188-L192 PolarHBondContact O-N 2.86Å
189	F	93.3	Very high	83.9	Confident	28 Å²	28	68 Å²	68	12%	0.123	34%	0.344	C	S	.	.	H	α-helix	trans	-68.8	-37.8	180	-165.9	-108.4	0	0	0	112.2	F138 T173 A177 P178 L184 D185 Y186 D187 N191 L192 I193	F138-F189 HydrophobicContact CE1-CD1 4.42Å; F138-F189 AromaticContact CE2-CD1 4Å; F138-F189 HydrophobicContact CE2-CD1 4Å; F138-F189 AromaticContact CZ-CD1 3.53Å; F138-F189 HydrophobicContact CZ-CD1 3.53Å; F138-F189 AromaticContact CZ-CE1 3.89Å; F138-F189 HydrophobicContact CZ-CE1 3.89Å; T173-F189 HydrophobicContact CG2-CE2 3.9Å; T173-F189 HydrophobicContact CG2-CZ 3.6Å; A177-F189 HydrophobicContact CB-CD2 4.05Å; A177-F189 HydrophobicContact CB-CE2 3.95Å; P178-F189 HydrophobicContact CG-CB 4.12Å; L184-F189 HydrophobicContact CD1-CB 4.3Å; L184-F189 HydrophobicContact CD1-CD2 4.06Å; L184-F189 HydrophobicContact CD1-CG 4.3Å; L184-F189 HydrophobicContact CD2-CB 4.35Å; L184-F189 HydrophobicContact CD2-CD1 4.44Å; L184-F189 HydrophobicContact CD2-CG 4.23Å; L184-F189 HydrophobicContact CG-CB 4.43Å; D185-F189 WeakPolarHBondContact O-CB 3.26Å; D185-F189 PolarHBondContact O-N 2.63Å; Y186-F189 PolarHBondContact O-N 2.78Å; D187-F189 PolarHBondContact O-N 3.48Å; F189-N191 VanDerWaalsContact C-N 3.33Å; F189-N191 PolarHBondContact O-N 3.01Å; F189-L192 HydrophobicContact CD2-CD2 3.86Å; F189-L192 HydrophobicContact CE2-CD2 4Å; F189-L192 WeakPolarHBondContact O-CB 3.46Å; F189-L192 PolarHBondContact O-N 3.41Å; F189-I193 HydrophobicContact CD1-CD1 3.68Å; F189-I193 HydrophobicContact CD1-CG1 4.33Å; F189-I193 HydrophobicContact CE1-CD1 3.63Å; F189-I193 HydrophobicContact CE1-CG1 4.22Å; F189-I193 HydrophobicContact CZ-CD1 4.5Å; F189-I193 VanDerWaalsContact O-CG1 3.31Å; F189-I193 WeakPolarHBondContact O-CG1 3.47Å; F189-I193 PolarHBondContact O-N 3.44Å
190	V	91.7	Very high	81.1	Confident	0 Å²	0	77 Å²	77	0%	0	39%	0.39	C	S	.	.	H	α-helix	trans	-63.5	-40.1	172	169.1	0	0	0	0	111.3	E131 L134 R135 F138 Y186 D187 L192 I193 K194	E131-V190 HydrophobicContact CB-CG1 4.28Å; E131-V190 HydrophobicContact CG-CG1 3.3Å; L134-V190 HydrophobicContact CB-CG1 4.03Å; L134-V190 HydrophobicContact CB-CG2 3.7Å; L134-V190 HydrophobicContact CD1-CG1 4.21Å; R135-V190 HydrophobicContact CG-CB 4.5Å; R135-V190 HydrophobicContact CG-CG1 4.36Å; R135-V190 HydrophobicContact CG-CG2 4.23Å; F138-V190 HydrophobicContact CD2-CG2 3.84Å; F138-V190 HydrophobicContact CE2-CG2 3.83Å; Y186-V190 WeakPolarHBondContact O-CB 3.38Å; Y186-V190 WeakPolarHBondContact O-CG2 3.4Å; Y186-V190 PolarHBondContact O-N 3.03Å; D187-V190 PolarHBondContact O-N 2.98Å; V190-L192 VanDerWaalsContact C-N 3.34Å; V190-I193 PolarHBondContact O-N 2.99Å; V190-K194 WeakPolarHBondContact O-CB 3.3Å; V190-K194 PolarHBondContact O-N 3.43Å
191	N	88.9	Confident	80.6	Confident	60 Å²	60	72.3 Å²	72.3	32%	0.321	37%	0.373	S	S	.	.	H	α-helix	trans	-62	-42.5	173.2	-77.9	-51.1	0	0	0	111.9	E131 D187 G188 F189 K194 R195	E131-N191 PolarHBondContact OE1-OD1 3.45Å; D187-N191 PolarHBondContact O-N 3.14Å; D187-N191 PolarHBondContact O-ND2 3.34Å; G188-N191 WeakPolarHBondContact O-CB 3.3Å; G188-N191 PolarHBondContact O-N 3.24Å; F189-N191 VanDerWaalsContact C-N 3.33Å; F189-N191 PolarHBondContact O-N 3.01Å; N191-K194 PolarHBondContact O-N 2.95Å; N191-R195 WeakPolarHBondContact O-CB 3.35Å; N191-R195 PolarHBondContact O-N 3.25Å
192	L	88.2	Confident	79.9	Confident	35 Å²	35	66.3 Å²	66.3	18%	0.183	35%	0.346	C	S	.	.	H	α-helix	trans	-58.2	-48.8	174.4	175.5	70.6	0	0	0	111.3	E176 G188 F189 V190 K194 G196 N197	E176-L192 HydrophobicContact CB-CD1 4.18Å; E176-L192 HydrophobicContact CB-CD2 4.01Å; E176-L192 WeakPolarHBondContact O-CD2 3.4Å; G188-L192 PolarHBondContact O-N 2.86Å; F189-L192 HydrophobicContact CD2-CD2 3.86Å; F189-L192 HydrophobicContact CE2-CD2 4Å; F189-L192 WeakPolarHBondContact O-CB 3.46Å; F189-L192 PolarHBondContact O-N 3.41Å; V190-L192 VanDerWaalsContact C-N 3.34Å; L192-K194 VanDerWaalsContact C-N 3.28Å; L192-K194 PolarHBondContact O-N 3.38Å; L192-G196 VanDerWaalsContact O-CA 3.27Å; L192-G196 WeakPolarHBondContact O-CA 3.34Å; L192-G196 PolarHBondContact O-N 3.41Å; L192-N197 WeakPolarHBondContact CD1-OD1 3.43Å
193	I	86.8	Confident	79.1	Confident	61 Å²	61	68.3 Å²	68.3	31%	0.313	35%	0.349	S	S	.	.	H	α-helix	trans	-58.7	-40.3	177.5	-69	166.2	0	0	0	111.4	T128 L134 F189 V190	T128-I193 HydrophobicContact CG2-CG2 3.53Å; L134-I193 HydrophobicContact CD1-CG2 3.94Å; F189-I193 HydrophobicContact CD1-CD1 3.68Å; F189-I193 HydrophobicContact CD1-CG1 4.33Å; F189-I193 HydrophobicContact CE1-CD1 3.63Å; F189-I193 HydrophobicContact CE1-CG1 4.22Å; F189-I193 HydrophobicContact CZ-CD1 4.5Å; F189-I193 VanDerWaalsContact O-CG1 3.31Å; F189-I193 WeakPolarHBondContact O-CG1 3.47Å; F189-I193 PolarHBondContact O-N 3.44Å; V190-I193 PolarHBondContact O-N 2.99Å
194	K	82.5	Confident	78.2	Confident	66 Å²	66	68.5 Å²	68.5	29%	0.287	35%	0.353	S	S	.	.	H	α-helix	trans	-86.5	-30.2	-173.3	-77.4	-58.8	-168.3	-173	0	115.6	T128 D129 E131 L134 V190 N191 L192	T128-K194 PolarHBondContact O-NZ 3.4Å; T128-K194 WeakPolarHBondContact OG1-CE 3.32Å; T128-K194 PolarHBondContact OG1-NZ 2.91Å; D129-K194 WeakPolarHBondContact O-CE 3.48Å; D129-K194 PolarHBondContact O-NZ 2.85Å; E131-K194 HydrophobicContact CG-CG 4.47Å; L134-K194 HydrophobicContact CD1-CD 4.47Å; L134-K194 HydrophobicContact CD1-CG 4.27Å; V190-K194 WeakPolarHBondContact O-CB 3.3Å; V190-K194 PolarHBondContact O-N 3.43Å; N191-K194 PolarHBondContact O-N 2.95Å; L192-K194 VanDerWaalsContact C-N 3.28Å; L192-K194 PolarHBondContact O-N 3.38Å
195	R	75.9	Confident	77.1	Confident	162 Å²	162	72.5 Å²	72.5	61%	0.611	37%	0.373	S	S	*	.	H	α-helix	trans	-121.1	-7.3	-169.6	-55.7	-177	-176.1	-146.4	0.8	113	N191	N191-R195 WeakPolarHBondContact O-CB 3.35Å; N191-R195 PolarHBondContact O-N 3.25Å
196	G	68.5	Low	75.8	Confident	39 Å²	39	72.5 Å²	72.5	40%	0.402	37%	0.372	S	S	.	.			trans	68.8	-177.8	-171	0	0	0	0	0	112.7	L192 Q198	L192-G196 VanDerWaalsContact O-CA 3.27Å; L192-G196 WeakPolarHBondContact O-CA 3.34Å; L192-G196 PolarHBondContact O-N 3.41Å; G196-Q198 PolarHBondContact O-N 3.41Å
197	N	58	Low	74.5	Confident	73 Å²	73	77.4 Å²	77.4	39%	0.39	40%	0.398	S	S	.	.			trans	-66	111	168	-78.8	48.5	0	0	0	109.3	E176 L192 D199	E176-N197 PolarHBondContact OE2-ND2 3.05Å; L192-N197 WeakPolarHBondContact CD1-OD1 3.43Å; N197-D199 PolarHBondContact ND2-OD2 3.36Å; N197-D199 PolarHBondContact O-N 3.23Å
198	Q	48.2	Very low	73	Confident	152 Å²	152	81.7 Å²	81.7	71%	0.71	42%	0.419	S	S	*	.			trans	-84.8	67.2	159.8	-66.3	-163.1	-14.3	0	0	109	G196 I200	G196-Q198 PolarHBondContact O-N 3.41Å; Q198-I200 PolarHBondContact O-N 2.72Å
199	D	40.9	Very low	71.4	Confident	134 Å²	134	86.8 Å²	86.8	72%	0.717	44%	0.437	S	S	*	.			trans	-85.4	95.7	162.2	-66.4	-47.6	0	0	0	107.3	N197	N197-D199 PolarHBondContact ND2-OD2 3.36Å; N197-D199 PolarHBondContact O-N 3.23Å
200	I	34.1	Very low	69.4	Low	232 Å²	232	92.2 Å²	92.2	100%	1.19	47%	0.466	S	S	*	.			trans	-102.9	0	160.9	-59.4	172.4	0	0	0	107.4	Q198	Q198-I200 PolarHBondContact O-N 2.72Å

Retrieved 200 of 200 residues in 38 ms (Link to these results)

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