A0A077YWT9_TRITR Loading...

HLH domain containing protein

AlphaFold DB , UniProt , Accession A0A077YWT9, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 185 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	47.9	Very low	65.3	Low	240 Å²	240	144.9 Å²	144.9	100%	1.182	85%	0.846	S	S	*	*				0	106.9	0	-67.9	161.1	85.5	0	0	106.9
2	S	66.7	Low	64.9	Low	120 Å²	120	144.5 Å²	144.5	84%	0.839	84%	0.838	S	S	*	*			trans	-127.4	98.9	-179.7	-57.2	0	0	0	0	108.2
3	T	66.7	Low	65	Low	145 Å²	145	144.3 Å²	144.3	89%	0.89	83%	0.832	S	S	*	*			trans	-91.1	109.9	170.6	51.1	0	0	0	0	108
4	T	70.7	Confident	64.8	Low	137 Å²	137	144.5 Å²	144.5	84%	0.84	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-92	129.8	168.1	50.9	0	0	0	0	109.2
5	K	69.6	Low	64.7	Low	206 Å²	206	148.2 Å²	148.2	90%	0.896	83%	0.832	S	S	*	*	P	Polyproline II helix	trans	-87.1	116.5	-176	-173.6	173.1	-178.3	179.2	0	108.7
6	S	69.6	Low	64.6	Low	108 Å²	108	151.2 Å²	151.2	76%	0.755	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-64.1	134.1	175.2	-64.1	0	0	0	0	111.1	S8	S6-S8 PolarHBondContact O-N 3.41Å
7	P	67.6	Low	64.6	Low	127 Å²	127	151.8 Å²	151.8	83%	0.825	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-68.6	126.5	175.5	-14.5	28.8	0	0	0	110.8	A9	P7-A9 PolarHBondContact O-N 3.35Å
8	S	61.9	Low	64.6	Low	116 Å²	116	153.1 Å²	153.1	81%	0.811	82%	0.818	S	S	*	*			trans	-66.6	111.2	172.6	-173	0	0	0	0	109.5	S6 K10	S6-S8 PolarHBondContact O-N 3.41Å; S8-K10 PolarHBondContact O-N 3.26Å
9	A	65.2	Low	64.5	Low	91 Å²	91	149.8 Å²	149.8	75%	0.752	81%	0.806	S	S	*	*			trans	-69.5	118.2	171.6	0	0	0	0	0	108.9	P7 V11	P7-A9 PolarHBondContact O-N 3.35Å; A9-V11 PolarHBondContact O-N 2.97Å
10	K	69	Low	64.3	Low	188 Å²	188	150.2 Å²	150.2	82%	0.817	81%	0.808	S	S	*	*			trans	-69.4	116.8	173.4	-65.2	177.3	178.9	174.1	0	108.1	S8 D12	S8-K10 PolarHBondContact O-N 3.26Å; K10-D12 PolarHBondContact O-N 3.47Å
11	V	63	Low	64.1	Low	116 Å²	116	147.7 Å²	147.7	70%	0.703	80%	0.797	S	S	*	*			trans	-80.2	113.3	164.4	179.3	0	0	0	0	105.9	A9 D13	A9-V11 PolarHBondContact O-N 2.97Å; V11-D13 VanDerWaalsContact C-N 3.35Å; V11-D13 PolarHBondContact O-N 3.35Å
12	D	61	Low	64.9	Low	140 Å²	140	146.5 Å²	146.5	75%	0.749	79%	0.785	S	S	*	*			trans	-72.7	90.6	175.1	-70.2	-40.8	0	0	0	109.3	K10 N14	K10-D12 PolarHBondContact O-N 3.47Å; D12-N14 PolarHBondContact O-N 3.5Å
13	D	65.8	Low	64.6	Low	142 Å²	142	148 Å²	148	76%	0.759	78%	0.779	S	S	*	*			trans	-70.7	15.5	174.1	-72.8	-34.6	0	0	0	113.6	V11 F15	V11-D13 VanDerWaalsContact C-N 3.35Å; V11-D13 PolarHBondContact O-N 3.35Å; D13-F15 PolarHBondContact O-N 3.28Å
14	N	62.9	Low	64.3	Low	147 Å²	147	145.8 Å²	145.8	79%	0.786	77%	0.77	S	S	*	*			trans	-98.3	25.9	-168.1	-83.6	-8	0	0	0	115.1	D12 Y16	D12-N14 PolarHBondContact O-N 3.5Å; N14-Y16 PolarHBondContact O-N 2.91Å; N14-Y16 VanDerWaalsContact O-N 3.1Å
15	F	63.7	Low	64.1	Low	200 Å²	200	147.2 Å²	147.2	88%	0.877	77%	0.771	S	S	*	*			trans	-84.9	48	162.7	-156.3	-98.1	0	0	0	111.1	D13 F17	D13-F15 PolarHBondContact O-N 3.28Å; F15-F17 PolarHBondContact O-N 3.3Å
16	Y	62.3	Low	64.1	Low	196 Å²	196	145 Å²	145	77%	0.769	76%	0.764	S	S	*	*			trans	-77.2	113.1	164.7	-157.8	-91.9	0	0	0	106.7	N14 K18	N14-Y16 PolarHBondContact O-N 2.91Å; N14-Y16 VanDerWaalsContact O-N 3.1Å; Y16-K18 VanDerWaalsContact C-N 3.25Å; Y16-K18 PolarHBondContact O-N 3.39Å
17	F	64.4	Low	64.2	Low	162 Å²	162	144.4 Å²	144.4	71%	0.711	76%	0.757	S	S	*	*			trans	-60.4	96.2	167.4	-175.2	-94.4	0	0	0	107.1	F15 P19	F15-F17 PolarHBondContact O-N 3.3Å; F17-P19 HydrophobicContact CD1-CB 4.39Å; F17-P19 HydrophobicContact CE1-CB 3.97Å; F17-P19 WeakPolarHBondContact O-CD 3.34Å
18	K	65.8	Low	64.2	Low	175 Å²	175	148.3 Å²	148.3	76%	0.761	76%	0.756	S	S	*	*			trans	-81.4	104.9	168.9	-129.9	176.5	178.5	179.3	0	104.4	Y16 D20	Y16-K18 VanDerWaalsContact C-N 3.25Å; Y16-K18 PolarHBondContact O-N 3.39Å; K18-D20 PolarHBondContact O-N 3.21Å
19	P	62.6	Low	64.7	Low	90 Å²	90	149.3 Å²	149.3	58%	0.584	75%	0.752	S	S	*	*			trans	-62.5	106.5	172.4	26.4	-32.1	0	0	0	106.8	F17 V21	F17-P19 HydrophobicContact CD1-CB 4.39Å; F17-P19 HydrophobicContact CE1-CB 3.97Å; F17-P19 WeakPolarHBondContact O-CD 3.34Å; P19-V21 PolarHBondContact O-N 3.23Å
20	D	59.2	Low	64.9	Low	158 Å²	158	155.1 Å²	155.1	85%	0.845	75%	0.754	S	S	*	*			trans	-83	56.5	179.2	-165.7	20.1	0	0	0	110.3	K18	K18-D20 PolarHBondContact O-N 3.21Å
21	V	61.1	Low	65	Low	97 Å²	97	157.2 Å²	157.2	59%	0.588	76%	0.757	S	S	*	*			trans	-158.6	123.8	156.9	-151	0	0	0	0	107.4	P19 E23	P19-V21 PolarHBondContact O-N 3.23Å; V21-E23 HydrophobicContact CB-CB 4.49Å; V21-E23 HydrophobicContact CB-CG 4.21Å; V21-E23 HydrophobicContact CG1-CG 3.89Å; V21-E23 PolarHBondContact O-N 3.45Å
22	K	63.7	Low	65	Low	215 Å²	215	162 Å²	162	94%	0.935	76%	0.762	S	S	*	*			trans	-69	64.1	155.3	-68.4	179	-178.9	177	0	108	S24	K22-S24 PolarHBondContact O-N 2.91Å
23	E	62	Low	65	Low	151 Å²	151	164.3 Å²	164.3	71%	0.706	77%	0.766	S	S	*	*			trans	-71.5	109.8	160.4	-92.7	177.7	177.5	0	0	105.5	V21 I25	V21-E23 HydrophobicContact CB-CB 4.49Å; V21-E23 HydrophobicContact CB-CG 4.21Å; V21-E23 HydrophobicContact CG1-CG 3.89Å; V21-E23 PolarHBondContact O-N 3.45Å; E23-I25 PolarHBondContact O-N 3.34Å
24	S	60.3	Low	64.4	Low	100 Å²	100	162.2 Å²	162.2	70%	0.699	76%	0.762	S	S	*	*			trans	-44.2	111.2	160	47.6	0	0	0	0	107	K22 E26	K22-S24 PolarHBondContact O-N 2.91Å; S24-E26 PolarHBondContact O-N 3.3Å
25	I	65.8	Low	64.2	Low	167 Å²	167	165 Å²	165	86%	0.856	76%	0.761	S	S	*	*			trans	-71.5	71	168.1	-57.5	161.4	0	0	0	104.8	E23 P27	E23-I25 PolarHBondContact O-N 3.34Å; I25-P27 WeakPolarHBondContact O-CD 2.92Å
26	E	68.5	Low	64	Low	160 Å²	160	160.4 Å²	160.4	75%	0.748	75%	0.75	S	S	*	*			trans	-68.4	119.9	171.4	-165.1	161.3	-161.9	0	0	105	S24 Y28	S24-E26 PolarHBondContact O-N 3.3Å; E26-Y28 PolarHBondContact O-N 3.36Å
27	P	72.1	Confident	63.5	Low	94 Å²	94	159.8 Å²	159.8	61%	0.61	75%	0.754	S	S	*	*			trans	-58.8	118.6	179.5	24.4	-31.6	0	0	0	106.4	I25 I29	I25-P27 WeakPolarHBondContact O-CD 2.92Å; P27-I29 HydrophobicContact CG-CG1 4.47Å; P27-I29 PolarHBondContact O-N 3.45Å
28	Y	67.1	Low	63.1	Low	209 Å²	209	162.1 Å²	162.1	82%	0.82	76%	0.758	S	S	*	*			trans	-66	85.5	170.5	-174.8	-102.5	0	0	0	107.7	E26 R30	E26-Y28 PolarHBondContact O-N 3.36Å; Y28-R30 VanDerWaalsContact C-N 3.28Å; Y28-R30 HydrophobicContact CD1-CB 4.44Å; Y28-R30 HydrophobicContact CE1-CB 4.3Å; Y28-R30 HydrophobicContact CE1-CG 4.38Å; Y28-R30 PolarHBondContact O-N 3.46Å
29	I	72.6	Confident	62.6	Low	138 Å²	138	162.5 Å²	162.5	71%	0.708	75%	0.754	S	S	*	*			trans	-66.7	96.8	170.9	-61.1	176.3	0	0	0	104.8	P27 R31	P27-I29 HydrophobicContact CG-CG1 4.47Å; P27-I29 PolarHBondContact O-N 3.45Å; I29-R31 VanDerWaalsContact C-N 3.32Å; I29-R31 PolarHBondContact O-N 3.43Å
30	R	70.5	Confident	62.4	Low	212 Å²	212	164.7 Å²	164.7	80%	0.8	76%	0.761	S	S	*	*			trans	-58.5	96.4	174.1	-166.5	-178.6	-155.2	146	4.9	107.7	Y28 R32	Y28-R30 VanDerWaalsContact C-N 3.28Å; Y28-R30 HydrophobicContact CD1-CB 4.44Å; Y28-R30 HydrophobicContact CE1-CB 4.3Å; Y28-R30 HydrophobicContact CE1-CG 4.38Å; Y28-R30 PolarHBondContact O-N 3.46Å; R30-R32 PolarHBondContact O-N 3.01Å
31	R	71.4	Confident	62.3	Low	232 Å²	232	164.2 Å²	164.2	88%	0.875	76%	0.764	S	S	*	*			trans	-49.2	114.2	173.4	-85.2	176.9	99.1	172.7	5.8	107.3	I29 K33	I29-R31 VanDerWaalsContact C-N 3.32Å; I29-R31 PolarHBondContact O-N 3.43Å; R31-K33 VanDerWaalsContact C-N 3.27Å; R31-K33 PolarHBondContact O-N 3.26Å
32	R	61.3	Low	62.5	Low	216 Å²	216	162.8 Å²	162.8	82%	0.815	75%	0.753	S	S	*	*			trans	-63.1	91	172.1	-103.9	179.8	164.3	150.6	-3.5	107.3	R30 S34	R30-R32 PolarHBondContact O-N 3.01Å; R32-S34 PolarHBondContact O-N 2.86Å
33	K	61.5	Low	62.9	Low	190 Å²	190	158.7 Å²	158.7	83%	0.826	74%	0.737	S	S	*	*			trans	-64.4	125.9	167.9	-163.8	162.7	-176.1	171.7	0	107.2	R31 R35	R31-K33 VanDerWaalsContact C-N 3.27Å; R31-K33 PolarHBondContact O-N 3.26Å; K33-R35 PolarHBondContact O-N 2.98Å
34	S	54	Low	63.8	Low	98 Å²	98	154 Å²	154	69%	0.685	73%	0.728	S	S	*	*			trans	-43.5	125.6	-174.6	42.8	0	0	0	0	112.5	R32 T36	R32-S34 PolarHBondContact O-N 2.86Å; S34-T36 PolarHBondContact O-N 3.42Å
35	R	57.7	Low	65.1	Low	205 Å²	205	150.8 Å²	150.8	77%	0.774	71%	0.711	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.5	11.2	-171.1	-79.2	178.7	154.5	171.7	-10.2	115.2	K33	K33-R35 PolarHBondContact O-N 2.98Å
36	T	60	Low	66.1	Low	103 Å²	103	147.5 Å²	147.5	63%	0.632	69%	0.693	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.9	-8.9	-156.9	11.7	0	0	0	0	116.5	S34	S34-T36 PolarHBondContact O-N 3.42Å
37	H	52	Low	67	Low	183 Å²	183	146.4 Å²	146.4	85%	0.847	69%	0.687	S	S	*	*	S	Bend	trans	-137.1	19.9	-170.3	-150.3	66.7	0	0	0	118
38	R	55	Low	68	Low	211 Å²	211	148 Å²	148	80%	0.796	69%	0.688	S	S	*	*			trans	-129.2	21.8	179.7	-94.1	-161	-179.2	-157.8	0.7	115.4	N40	R38-N40 PolarHBondContact O-N 2.9Å
39	R	57	Low	69.3	Low	184 Å²	184	144.8 Å²	144.8	69%	0.694	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.7	-19.9	-166.3	-79.2	-176.5	-79.3	161.1	-2.3	116.1
40	N	56.5	Low	70.3	Confident	136 Å²	136	141.5 Å²	141.5	73%	0.727	66%	0.661	S	S	*	*	T	Hydrogen-bonded Turn	trans	-113.1	-8.8	-168.8	-65	-23.3	0	0	0	116.4	R38	R38-N40 PolarHBondContact O-N 2.9Å
41	V	58.1	Low	71.5	Confident	148 Å²	148	138.7 Å²	138.7	90%	0.897	66%	0.655	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.9	-12.9	-174.5	-172.7	0	0	0	0	112.9
42	D	66.4	Low	72.6	Confident	67 Å²	67	131 Å²	131	36%	0.358	63%	0.63	S	S	.	*	S	Bend	trans	-105.3	10.3	-178.6	-158.4	15.9	0	0	0	112.3	G45 Q46	D42-G45 PolarHBondContact O-N 2.89Å; D42-Q46 WeakPolarHBondContact O-CB 3.27Å; D42-Q46 PolarHBondContact O-N 3.24Å
43	E	71.9	Confident	74.3	Confident	129 Å²	129	125 Å²	125	60%	0.603	62%	0.615	S	S	*	*	H	α-helix	trans	-64	-48.2	-175.8	-68.2	-167.6	156.8	0	0	112	G45 Q46 E47	E43-G45 VanDerWaalsContact C-N 3.34Å; E43-G45 PolarHBondContact O-N 2.86Å; E43-Q46 PolarHBondContact O-N 3.44Å; E43-E47 WeakPolarHBondContact O-CB 3.41Å; E43-E47 PolarHBondContact O-N 3.02Å
44	G	80.2	Confident	76.1	Confident	51 Å²	51	119.8 Å²	119.8	53%	0.526	60%	0.602	S	S	.	*	H	α-helix	trans	-65.2	-35.7	176.1	0	0	0	0	0	113.3	M48	G44-M48 WeakPolarHBondContact O-CB 3.32Å; G44-M48 PolarHBondContact O-N 2.94Å
45	G	86.7	Confident	78.2	Confident	33 Å²	33	121.6 Å²	121.6	34%	0.34	59%	0.593	S	S	.	*	H	α-helix	trans	-67.7	-40.5	174.5	0	0	0	0	0	112.3	D42 E43 R49	D42-G45 PolarHBondContact O-N 2.89Å; E43-G45 VanDerWaalsContact C-N 3.34Å; E43-G45 PolarHBondContact O-N 2.86Å; G45-R49 WeakPolarHBondContact O-CB 3.38Å; G45-R49 VanDerWaalsContact O-CG 3.23Å; G45-R49 WeakPolarHBondContact O-CG 3.31Å; G45-R49 PolarHBondContact O-N 3.25Å
46	Q	86.9	Confident	80.1	Confident	99 Å²	99	115.5 Å²	115.5	46%	0.463	57%	0.574	S	S	.	*	H	α-helix	trans	-67.8	-40.8	176.5	-175	61.9	15.1	0	0	111.6	D42 E43 R49 T50	D42-Q46 WeakPolarHBondContact O-CB 3.27Å; D42-Q46 PolarHBondContact O-N 3.24Å; E43-Q46 PolarHBondContact O-N 3.44Å; Q46-R49 WeakPolarHBondContact O-CB 3.47Å; Q46-R49 PolarHBondContact O-N 3.21Å; Q46-T50 WeakPolarHBondContact O-CG2 3.39Å; Q46-T50 PolarHBondContact O-N 3.42Å; Q46-T50 PolarHBondContact O-OG1 3.33Å
47	E	88.9	Confident	81.9	Confident	137 Å²	137	118.9 Å²	118.9	64%	0.64	58%	0.575	S	S	*	*	H	α-helix	trans	-64.7	-43.4	174.5	-170	-175.8	176.5	0	0	112	E43 R49 T50 K51	E43-E47 WeakPolarHBondContact O-CB 3.41Å; E43-E47 PolarHBondContact O-N 3.02Å; E47-R49 VanDerWaalsContact C-N 3.31Å; E47-R49 PolarHBondContact O-N 2.91Å; E47-T50 WeakPolarHBondContact CA-OG1 3.46Å; E47-T50 PolarHBondContact O-N 2.83Å; E47-T50 PolarHBondContact O-OG1 2.7Å; E47-K51 WeakPolarHBondContact O-CB 3.45Å; E47-K51 PolarHBondContact O-N 3.22Å
48	M	92.2	Very high	84.1	Confident	126 Å²	126	116.1 Å²	116.1	62%	0.621	56%	0.561	S	S	*	*	H	α-helix	trans	-61.5	-42.2	174.9	-174.3	178.4	-73.1	0	0	111.2	G44 K51 I52	G44-M48 WeakPolarHBondContact O-CB 3.32Å; G44-M48 PolarHBondContact O-N 2.94Å; M48-K51 PolarHBondContact O-N 3.46Å; M48-I52 HydrophobicContact CG-CD1 3.94Å; M48-I52 VanDerWaalsContact O-CG1 3.27Å; M48-I52 WeakPolarHBondContact O-CG1 3.31Å; M48-I52 PolarHBondContact O-N 2.79Å
49	R	93.7	Very high	86.2	Confident	142 Å²	142	112.9 Å²	112.9	54%	0.536	55%	0.548	S	S	.	.	H	α-helix	trans	-61	-45.4	174.6	-77.9	171.2	168	171.5	2.5	112.1	G45 Q46 E47 I52 N53	G45-R49 WeakPolarHBondContact O-CB 3.38Å; G45-R49 VanDerWaalsContact O-CG 3.23Å; G45-R49 WeakPolarHBondContact O-CG 3.31Å; G45-R49 PolarHBondContact O-N 3.25Å; Q46-R49 WeakPolarHBondContact O-CB 3.47Å; Q46-R49 PolarHBondContact O-N 3.21Å; E47-R49 VanDerWaalsContact C-N 3.31Å; E47-R49 PolarHBondContact O-N 2.91Å; R49-I52 PolarHBondContact O-N 3.1Å; R49-N53 WeakPolarHBondContact O-CB 3.28Å; R49-N53 PolarHBondContact O-N 3.48Å; R49-N53 PolarHBondContact O-ND2 2.74Å
50	T	93.7	Very high	88.2	Confident	70 Å²	70	107.6 Å²	107.6	43%	0.429	53%	0.532	S	S	.	.	H	α-helix	trans	-65.9	-39.4	178.2	56	0	0	0	0	111.5	Q46 E47 N53 S54	Q46-T50 WeakPolarHBondContact O-CG2 3.39Å; Q46-T50 PolarHBondContact O-N 3.42Å; Q46-T50 PolarHBondContact O-OG1 3.33Å; E47-T50 WeakPolarHBondContact CA-OG1 3.46Å; E47-T50 PolarHBondContact O-N 2.83Å; E47-T50 PolarHBondContact O-OG1 2.7Å; T50-N53 PolarHBondContact O-N 3.42Å; T50-S54 WeakPolarHBondContact O-CB 3.35Å; T50-S54 PolarHBondContact O-N 2.97Å
51	K	95.8	Very high	90.1	Very high	153 Å²	153	106.3 Å²	106.3	67%	0.665	52%	0.522	S	S	*	.	H	α-helix	trans	-61.4	-46.2	174.8	-171	176.6	-177.6	176.4	0	112.2	E47 M48 S54 R55	E47-K51 WeakPolarHBondContact O-CB 3.45Å; E47-K51 PolarHBondContact O-N 3.22Å; M48-K51 PolarHBondContact O-N 3.46Å; K51-S54 PolarHBondContact O-N 3.32Å; K51-R55 PolarHBondContact O-N 2.95Å; K51-R55 VanDerWaalsContact O-N 3.09Å
52	I	95.1	Very high	92	Very high	71 Å²	71	101.9 Å²	101.9	36%	0.364	49%	0.493	S	S	.	.	H	α-helix	trans	-62.9	-45.7	176.3	-69	166.6	0	0	0	110.8	M48 R49 S54 R55 E56	M48-I52 HydrophobicContact CG-CD1 3.94Å; M48-I52 VanDerWaalsContact O-CG1 3.27Å; M48-I52 WeakPolarHBondContact O-CG1 3.31Å; M48-I52 PolarHBondContact O-N 2.79Å; R49-I52 PolarHBondContact O-N 3.1Å; I52-S54 PolarHBondContact O-N 3.43Å; I52-R55 WeakPolarHBondContact O-CB 3.35Å; I52-R55 PolarHBondContact O-N 3.38Å; I52-E56 PolarHBondContact O-N 3.47Å
53	N	97.9	Very high	93.5	Very high	90 Å²	90	103 Å²	103	48%	0.481	50%	0.499	S	S	.	.	H	α-helix	trans	-63.4	-40.8	179.3	-71.8	-19.9	0	0	0	112.2	R49 T50 R55 E56 R57	R49-N53 WeakPolarHBondContact O-CB 3.28Å; R49-N53 PolarHBondContact O-N 3.48Å; R49-N53 PolarHBondContact O-ND2 2.74Å; T50-N53 PolarHBondContact O-N 3.42Å; N53-R55 VanDerWaalsContact C-N 3.32Å; N53-R55 PolarHBondContact O-N 3.27Å; N53-E56 PolarHBondContact O-N 2.97Å; N53-R57 WeakPolarHBondContact O-CG 3.42Å; N53-R57 PolarHBondContact O-N 3.44Å
54	S	97.8	Very high	94.8	Very high	79 Å²	79	99.7 Å²	99.7	55%	0.552	49%	0.485	S	S	*	.	H	α-helix	trans	-59.9	-43.8	174.8	-174.9	0	0	0	0	111.2	T50 K51 I52 R57 K58	T50-S54 WeakPolarHBondContact O-CB 3.35Å; T50-S54 PolarHBondContact O-N 2.97Å; K51-S54 PolarHBondContact O-N 3.32Å; I52-S54 PolarHBondContact O-N 3.43Å; S54-R57 PolarHBondContact O-N 2.95Å; S54-K58 PolarHBondContact O-N 3.02Å
55	R	98.1	Very high	95.6	Very high	136 Å²	136	103.5 Å²	103.5	51%	0.513	49%	0.489	S	S	.	.	H	α-helix	trans	-62.2	-46.6	176.7	-173.3	178.6	68.2	-132.6	2.7	112.7	K51 I52 N53 R57 K58 R59	K51-R55 PolarHBondContact O-N 2.95Å; K51-R55 VanDerWaalsContact O-N 3.09Å; I52-R55 WeakPolarHBondContact O-CB 3.35Å; I52-R55 PolarHBondContact O-N 3.38Å; N53-R55 VanDerWaalsContact C-N 3.32Å; N53-R55 PolarHBondContact O-N 3.27Å; R55-R57 VanDerWaalsContact C-N 3.35Å; R55-K58 WeakPolarHBondContact O-CB 3.47Å; R55-K58 PolarHBondContact O-N 2.94Å; R55-R59 PolarHBondContact O-N 2.84Å
56	E	98.3	Very high	96.1	Very high	78 Å²	78	104.8 Å²	104.8	36%	0.364	50%	0.496	S	S	.	.	H	α-helix	trans	-67.8	-35.1	179.5	-176.4	56	-152.8	0	0	111.9	I52 N53 K58 R59 M60	I52-E56 PolarHBondContact O-N 3.47Å; N53-E56 PolarHBondContact O-N 2.97Å; E56-K58 PolarHBondContact O-N 3.08Å; E56-R59 PolarHBondContact O-N 3.29Å; E56-R59 IonicContact OE1-NH1 2.79Å; E56-R59 VanDerWaalsContact OE2-CD 3.26Å; E56-R59 WeakPolarHBondContact OE2-CD 3.13Å; E56-R59 IonicContact OE2-NH1 3.81Å; E56-R59 PolarHBondContact OE2-NH1 3.14Å; E56-M60 WeakPolarHBondContact O-CB 3.31Å; E56-M60 PolarHBondContact O-N 3.23Å
57	R	98.5	Very high	96.6	Very high	173 Å²	173	101 Å²	101	65%	0.653	48%	0.479	S	S	*	.	H	α-helix	trans	-58.4	-48.3	170.3	-74.4	179	-166.5	-173.2	4.3	111	N53 S54 R55 R59 M60 H61	N53-R57 WeakPolarHBondContact O-CG 3.42Å; N53-R57 PolarHBondContact O-N 3.44Å; S54-R57 PolarHBondContact O-N 2.95Å; R55-R57 VanDerWaalsContact C-N 3.35Å; R57-R59 VanDerWaalsContact C-N 3.33Å; R57-R59 PolarHBondContact O-N 3.25Å; R57-M60 PolarHBondContact O-N 3.17Å; R57-H61 PolarHBondContact O-CD2 2.95Å; R57-H61 PolarHBondContact O-N 3.39Å
58	K	98.2	Very high	96.9	Very high	126 Å²	126	97.2 Å²	97.2	55%	0.548	46%	0.461	S	S	.	.	H	α-helix	trans	-56.5	-48	176.2	-173.4	-173	176.6	-63.8	0	111.2	S54 R55 E56 M60 H61 D62	S54-K58 PolarHBondContact O-N 3.02Å; R55-K58 WeakPolarHBondContact O-CB 3.47Å; R55-K58 PolarHBondContact O-N 2.94Å; E56-K58 PolarHBondContact O-N 3.08Å; K58-M60 VanDerWaalsContact C-N 3.31Å; K58-M60 PolarHBondContact O-N 3.35Å; K58-H61 WeakPolarHBondContact O-CB 3.34Å; K58-H61 PolarHBondContact O-N 3.14Å; K58-H61 VanDerWaalsContact O-N 3.13Å; K58-D62 IonicContact NZ-OD1 3.72Å; K58-D62 IonicContact NZ-OD2 2.81Å; K58-D62 PolarHBondContact NZ-OD2 3.02Å; K58-D62 PolarHBondContact O-N 3.49Å
59	R	98.2	Very high	97	Very high	142 Å²	142	93.5 Å²	93.5	54%	0.536	45%	0.45	S	S	.	.	H	α-helix	trans	-57.8	-43	176.8	-173.3	-168.1	176.6	-159.1	0.7	112.2	R55 E56 R57 D62 L63	R55-R59 PolarHBondContact O-N 2.84Å; E56-R59 PolarHBondContact O-N 3.29Å; E56-R59 IonicContact OE1-NH1 2.79Å; E56-R59 VanDerWaalsContact OE2-CD 3.26Å; E56-R59 WeakPolarHBondContact OE2-CD 3.13Å; E56-R59 IonicContact OE2-NH1 3.81Å; E56-R59 PolarHBondContact OE2-NH1 3.14Å; R57-R59 VanDerWaalsContact C-N 3.33Å; R57-R59 PolarHBondContact O-N 3.25Å; R59-D62 PolarHBondContact O-N 3.01Å; R59-L63 PolarHBondContact O-N 2.9Å
60	M	98.4	Very high	97.2	Very high	74 Å²	74	89.3 Å²	89.3	37%	0.365	44%	0.438	S	S	.	.	H	α-helix	trans	-66.7	-35.9	177.1	-172.4	60.5	60.3	0	0	112.2	E56 R57 K58 L63 N64	E56-M60 WeakPolarHBondContact O-CB 3.31Å; E56-M60 PolarHBondContact O-N 3.23Å; R57-M60 PolarHBondContact O-N 3.17Å; K58-M60 VanDerWaalsContact C-N 3.31Å; K58-M60 PolarHBondContact O-N 3.35Å; M60-L63 HydrophobicContact SD-CD2 4.14Å; M60-N64 WeakPolarHBondContact O-CB 3.26Å; M60-N64 PolarHBondContact O-N 3.46Å; M60-N64 PolarHBondContact O-ND2 2.84Å; M60-N64 VanDerWaalsContact O-ND2 3.13Å
61	H	98.3	Very high	97.3	Very high	108 Å²	108	86.9 Å²	86.9	50%	0.5	42%	0.421	S	S	.	.	H	α-helix	trans	-64	-47	172.3	-71.5	-62.5	0	0	0	111.2	R57 K58 L63 N64 H65	R57-H61 PolarHBondContact O-CD2 2.95Å; R57-H61 PolarHBondContact O-N 3.39Å; K58-H61 WeakPolarHBondContact O-CB 3.34Å; K58-H61 PolarHBondContact O-N 3.14Å; K58-H61 VanDerWaalsContact O-N 3.13Å; H61-L63 VanDerWaalsContact C-N 3.32Å; H61-L63 PolarHBondContact O-N 3.45Å; H61-N64 CarbonylContact O-C 3.59Å; H61-N64 PolarHBondContact O-N 3.38Å; H61-N64 VanDerWaalsContact O-N 3.09Å; H61-H65 PolarHBondContact O-CD2 3.39Å; H61-H65 PolarHBondContact O-N 3.22Å
62	D	97.7	Very high	97.1	Very high	56 Å²	56	83.2 Å²	83.2	30%	0.299	41%	0.407	S	S	.	.	H	α-helix	trans	-57.9	-44.2	176.9	-64.5	-25	0	0	0	111	K58 R59 H65 A66	K58-D62 IonicContact NZ-OD1 3.72Å; K58-D62 IonicContact NZ-OD2 2.81Å; K58-D62 PolarHBondContact NZ-OD2 3.02Å; K58-D62 PolarHBondContact O-N 3.49Å; R59-D62 PolarHBondContact O-N 3.01Å; D62-H65 PolarHBondContact O-N 3.3Å; D62-A66 PolarHBondContact O-N 3.5Å
63	L	98.1	Very high	97.1	Very high	91 Å²	91	82.4 Å²	82.4	48%	0.476	40%	0.404	S	S	.	.	H	α-helix	trans	-61.6	-44.3	173.7	175.4	61.5	0	0	0	112.4	R59 M60 H61 H65 A66 M67	R59-L63 PolarHBondContact O-N 2.9Å; M60-L63 HydrophobicContact SD-CD2 4.14Å; H61-L63 VanDerWaalsContact C-N 3.32Å; H61-L63 PolarHBondContact O-N 3.45Å; L63-H65 VanDerWaalsContact C-N 3.3Å; L63-H65 PolarHBondContact O-N 3.11Å; L63-A66 PolarHBondContact O-N 3.02Å; L63-M67 WeakPolarHBondContact O-CG 3.31Å; L63-M67 PolarHBondContact O-N 2.94Å
64	N	97.8	Very high	96.9	Very high	58 Å²	58	78.7 Å²	78.7	31%	0.31	38%	0.384	S	S	.	.	H	α-helix	trans	-66.7	-33	178.9	-72.6	-30.2	0	0	0	111.8	M60 H61 M67 E68 K87	M60-N64 WeakPolarHBondContact O-CB 3.26Å; M60-N64 PolarHBondContact O-N 3.46Å; M60-N64 PolarHBondContact O-ND2 2.84Å; M60-N64 VanDerWaalsContact O-ND2 3.13Å; H61-N64 CarbonylContact O-C 3.59Å; H61-N64 PolarHBondContact O-N 3.38Å; H61-N64 VanDerWaalsContact O-N 3.09Å; N64-M67 PolarHBondContact O-N 3.2Å; N64-E68 PolarHBondContact O-N 2.74Å; N64-K87 VanDerWaalsContact OD1-CE 3.26Å; N64-K87 WeakPolarHBondContact OD1-CE 3.49Å; N64-K87 PolarHBondContact OD1-NZ 3.22Å
65	H	97.4	Very high	96.4	Very high	132 Å²	132	77 Å²	77	61%	0.611	37%	0.372	S	S	*	.	H	α-helix	trans	-65	-45	171.5	-75.7	-63.3	0	0	0	111.6	H61 D62 L63 M67 E68 A69	H61-H65 PolarHBondContact O-CD2 3.39Å; H61-H65 PolarHBondContact O-N 3.22Å; D62-H65 PolarHBondContact O-N 3.3Å; L63-H65 VanDerWaalsContact C-N 3.3Å; L63-H65 PolarHBondContact O-N 3.11Å; H65-M67 VanDerWaalsContact C-N 3.31Å; H65-M67 PolarHBondContact O-N 2.92Å; H65-E68 WeakPolarHBondContact O-CB 3.28Å; H65-E68 PolarHBondContact O-N 3.47Å; H65-E68 VanDerWaalsContact O-N 3.07Å; H65-A69 PolarHBondContact O-N 3.04Å
66	A	97.2	Very high	95.8	Very high	60 Å²	60	78.2 Å²	78.2	50%	0.496	38%	0.381	S	S	.	.	H	α-helix	trans	-60.6	-40.1	174	0	0	0	0	0	112.1	D62 L63 E68 A69 L70	D62-A66 PolarHBondContact O-N 3.5Å; L63-A66 PolarHBondContact O-N 3.02Å; A66-E68 VanDerWaalsContact C-N 3.27Å; A66-E68 PolarHBondContact O-N 3.47Å; A66-A69 PolarHBondContact O-N 3.01Å; A66-L70 PolarHBondContact O-N 3.05Å
67	M	97.3	Very high	95	Very high	20 Å²	20	75.4 Å²	75.4	10%	0.099	37%	0.373	C	S	.	.	H	α-helix	trans	-61.9	-34.2	173.6	-77.5	-63.1	-66.9	0	0	112.7	L63 N64 H65 R71 K87 T90 L91	L63-M67 WeakPolarHBondContact O-CG 3.31Å; L63-M67 PolarHBondContact O-N 2.94Å; N64-M67 PolarHBondContact O-N 3.2Å; H65-M67 VanDerWaalsContact C-N 3.31Å; H65-M67 PolarHBondContact O-N 2.92Å; M67-R71 WeakPolarHBondContact O-CG 3.35Å; M67-R71 PolarHBondContact O-N 3.2Å; M67-R71 PolarHBondContact O-NH1 3.23Å; M67-K87 HydrophobicContact CE-CB 4.12Å; M67-K87 HydrophobicContact CE-CG 4.21Å; M67-T90 HydrophobicContact CE-CG2 3.9Å; M67-L91 HydrophobicContact CE-CD2 4.47Å; M67-L91 HydrophobicContact CE-CG 4.4Å; M67-L91 HydrophobicContact SD-CD2 4.29Å
68	E	95.1	Very high	94.3	Very high	57 Å²	57	74.8 Å²	74.8	27%	0.266	38%	0.375	S	S	.	.	H	α-helix	trans	-73.3	-43.2	175.4	-168.7	56	-138.2	0	0	111.8	N64 H65 A66 L70 R71 Q72 K84	N64-E68 PolarHBondContact O-N 2.74Å; H65-E68 WeakPolarHBondContact O-CB 3.28Å; H65-E68 PolarHBondContact O-N 3.47Å; H65-E68 VanDerWaalsContact O-N 3.07Å; A66-E68 VanDerWaalsContact C-N 3.27Å; A66-E68 PolarHBondContact O-N 3.47Å; E68-L70 PolarHBondContact O-N 3.45Å; E68-R71 WeakPolarHBondContact O-CA 3.34Å; E68-R71 WeakPolarHBondContact O-CB 3.25Å; E68-R71 PolarHBondContact O-N 3.4Å; E68-R71 IonicContact OE2-CZ 3.7Å; E68-R71 IonicContact OE2-NH1 3.61Å; E68-R71 PolarHBondContact OE2-NH1 3.03Å; E68-Q72 WeakPolarHBondContact O-CG 3.45Å; E68-Q72 PolarHBondContact O-N 3.12Å; E68-Q72 VanDerWaalsContact O-N 3.1Å; E68-Q72 PolarHBondContact OE1-NE2 2.92Å; E68-K84 WeakPolarHBondContact OE2-CE 3.36Å; E68-K84 IonicContact OE2-NZ 3.71Å; E68-K84 PolarHBondContact OE2-NZ 3.28Å
69	A	95	Very high	93.7	Very high	47 Å²	47	72.1 Å²	72.1	39%	0.388	37%	0.367	S	S	.	.	H	α-helix	trans	-56.4	-39.5	173.1	0	0	0	0	0	111.9	H65 A66 R71 Q72 V73	H65-A69 PolarHBondContact O-N 3.04Å; A66-A69 PolarHBondContact O-N 3.01Å; A69-R71 VanDerWaalsContact C-N 3.33Å; A69-R71 PolarHBondContact O-N 2.9Å; A69-Q72 PolarHBondContact O-N 3.15Å; A69-V73 PolarHBondContact O-N 2.71Å
70	L	97	Very high	93	Very high	54 Å²	54	71.5 Å²	71.5	28%	0.283	38%	0.381	S	S	.	.	H	α-helix	trans	-61.3	-39.3	172.8	-179.4	59.1	0	0	0	112.2	A66 E68 Q72 V73 M74 T90 A94	A66-L70 PolarHBondContact O-N 3.05Å; E68-L70 PolarHBondContact O-N 3.45Å; L70-Q72 VanDerWaalsContact C-N 3.31Å; L70-Q72 PolarHBondContact O-N 3.28Å; L70-V73 HydrophobicContact CD1-CG2 4.02Å; L70-V73 WeakPolarHBondContact O-CG2 3.48Å; L70-V73 PolarHBondContact O-N 3.19Å; L70-M74 WeakPolarHBondContact O-CG 3.34Å; L70-T90 HydrophobicContact CD2-CG2 3.88Å; L70-T90 HydrophobicContact CG-CG2 4.1Å; L70-A94 HydrophobicContact CD1-CB 4.09Å; L70-A94 HydrophobicContact CD2-CB 4.09Å; L70-A94 HydrophobicContact CG-CB 4.38Å
71	R	95.6	Very high	92.4	Very high	19 Å²	19	73.7 Å²	73.7	7%	0.072	40%	0.399	C	S	.	.	H	α-helix	trans	-63	-39.5	175.7	-67.6	-177.4	-167.8	89.1	14.8	111.6	M67 E68 A69 V73 M74 G77 L85 T90	M67-R71 WeakPolarHBondContact O-CG 3.35Å; M67-R71 PolarHBondContact O-N 3.2Å; M67-R71 PolarHBondContact O-NH1 3.23Å; E68-R71 WeakPolarHBondContact O-CA 3.34Å; E68-R71 WeakPolarHBondContact O-CB 3.25Å; E68-R71 PolarHBondContact O-N 3.4Å; E68-R71 IonicContact OE2-CZ 3.7Å; E68-R71 IonicContact OE2-NH1 3.61Å; E68-R71 PolarHBondContact OE2-NH1 3.03Å; A69-R71 VanDerWaalsContact C-N 3.33Å; A69-R71 PolarHBondContact O-N 2.9Å; R71-V73 PolarHBondContact O-N 3.02Å; R71-M74 HydrophobicContact CG-CE 4.31Å; R71-M74 PolarHBondContact O-N 2.95Å; R71-M74 VanDerWaalsContact O-N 3.08Å; R71-G77 WeakPolarHBondContact O-CA 3.43Å; R71-L85 PolarHBondContact NE-O 3.19Å; R71-L85 PolarHBondContact NH2-O 3.15Å; R71-T90 HydrophobicContact CG-CG2 4Å; R71-T90 PolarHBondContact NE-OG1 3.11Å
72	Q	93.3	Very high	91.7	Very high	77 Å²	77	71.3 Å²	71.3	36%	0.36	39%	0.392	S	S	.	.	H	α-helix	trans	-64.4	-21.4	-178.8	-62.1	-56.1	-40.8	0	0	114.2	E68 A69 L70 K78	E68-Q72 WeakPolarHBondContact O-CG 3.45Å; E68-Q72 PolarHBondContact O-N 3.12Å; E68-Q72 VanDerWaalsContact O-N 3.1Å; E68-Q72 PolarHBondContact OE1-NE2 2.92Å; A69-Q72 PolarHBondContact O-N 3.15Å; L70-Q72 VanDerWaalsContact C-N 3.31Å; L70-Q72 PolarHBondContact O-N 3.28Å; Q72-K78 WeakPolarHBondContact O-CE 3.1Å; Q72-K78 WeakPolarHBondContact O-CG 3.35Å
73	V	94.3	Very high	91.3	Very high	53 Å²	53	79.8 Å²	79.8	32%	0.321	42%	0.42	S	S	.	.	H	α-helix	trans	-93.7	-9.1	176.3	-59.4	0	0	0	0	113.6	A69 L70 R71 W146	A69-V73 PolarHBondContact O-N 2.71Å; L70-V73 HydrophobicContact CD1-CG2 4.02Å; L70-V73 WeakPolarHBondContact O-CG2 3.48Å; L70-V73 PolarHBondContact O-N 3.19Å; R71-V73 PolarHBondContact O-N 3.02Å; V73-W146 HydrophobicContact CG1-CD2 4.45Å; V73-W146 HydrophobicContact CG1-CH2 4.01Å; V73-W146 HydrophobicContact CG1-CZ2 3.67Å
74	M	92.9	Very high	91	Very high	12 Å²	12	82 Å²	82	6%	0.059	43%	0.426	C	S	.	.	S	Bend	trans	-77.9	146.2	176.6	-66.9	-169.9	-37.1	0	0	111	L70 R71 F76 G77 L85 T90 F93 A94	L70-M74 WeakPolarHBondContact O-CG 3.34Å; R71-M74 HydrophobicContact CG-CE 4.31Å; R71-M74 PolarHBondContact O-N 2.95Å; R71-M74 VanDerWaalsContact O-N 3.08Å; M74-F76 PolarHBondContact O-N 3.4Å; M74-G77 PolarHBondContact O-N 3.45Å; M74-L85 HydrophobicContact CE-CD1 3.65Å; M74-T90 HydrophobicContact CE-CG2 4.06Å; M74-T90 HydrophobicContact SD-CG2 4.12Å; M74-F93 HydrophobicContact CB-CD1 4.15Å; M74-F93 HydrophobicContact CB-CE1 3.86Å; M74-F93 HydrophobicContact CE-CD1 3.98Å; M74-F93 HydrophobicContact CE-CE1 4.5Å; M74-F93 HydrophobicContact CE-CG 4.46Å; M74-F93 HydrophobicContact CG-CD1 3.93Å; M74-F93 HydrophobicContact CG-CE1 4.12Å; M74-F93 HydrophobicContact SD-CB 4.1Å; M74-F93 HydrophobicContact SD-CD1 3.28Å; M74-F93 WeakPolarHBondContact SD-CD1 3.26Å; M74-F93 HydrophobicContact SD-CE1 4.01Å; M74-F93 HydrophobicContact SD-CG 4.04Å; M74-A94 HydrophobicContact SD-CB 4.31Å
75	P	88.2	Confident	90.8	Very high	45 Å²	45	82.5 Å²	82.5	29%	0.292	43%	0.428	S	S	.	.	T	Hydrogen-bonded Turn	trans	-47.2	129.8	164.3	-27.7	30.3	0	0	0	110	G77 F93 Y97	P75-G77 PolarHBondContact O-N 3.42Å; P75-F93 HydrophobicContact CB-CZ 4.48Å; P75-F93 HydrophobicContact CG-CE1 4.49Å; P75-Y97 VanDerWaalsContact CD-CE1 3.47Å; P75-Y97 HydrophobicContact CG-CD1 4.5Å; P75-Y97 HydrophobicContact CG-CD2 3.71Å; P75-Y97 HydrophobicContact CG-CE1 4.18Å; P75-Y97 HydrophobicContact CG-CE2 3.33Å; P75-Y97 HydrophobicContact CG-CG 4.29Å
76	F	86.2	Confident	90.7	Very high	160 Å²	160	79.3 Å²	79.3	70%	0.702	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.4	-9.8	-176.6	-38.6	-67.1	0	0	0	116.7	M74 K78 D79 T82	M74-F76 PolarHBondContact O-N 3.4Å; F76-K78 PolarHBondContact O-N 3.02Å; F76-K78 VanDerWaalsContact O-N 3.15Å; F76-D79 PolarHBondContact O-N 3.43Å; F76-D79 VanDerWaalsContact O-N 3.12Å; F76-T82 HydrophobicContact CB-CG2 4.11Å; F76-T82 PolarHBondContact O-OG1 2.86Å
77	G	81.3	Confident	90.7	Very high	19 Å²	19	81.1 Å²	81.1	20%	0.196	42%	0.417	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71	-11.7	-175.6	0	0	0	0	0	115.8	R71 M74 P75	R71-G77 WeakPolarHBondContact O-CA 3.43Å; M74-G77 PolarHBondContact O-N 3.45Å; P75-G77 PolarHBondContact O-N 3.42Å
78	K	82.4	Confident	90.7	Very high	160 Å²	160	85.2 Å²	85.2	70%	0.696	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.5	-15.2	174.5	-60.2	-179	-177.5	179.2	0	113.2	Q72 F76 P80	Q72-K78 WeakPolarHBondContact O-CE 3.1Å; Q72-K78 WeakPolarHBondContact O-CG 3.35Å; F76-K78 PolarHBondContact O-N 3.02Å; F76-K78 VanDerWaalsContact O-N 3.15Å; K78-P80 WeakPolarHBondContact O-CD 3.01Å
79	D	86.2	Confident	90.7	Very high	71 Å²	71	85.1 Å²	85.1	38%	0.38	45%	0.448	S	S	.	.			trans	-79.2	115.7	-175.7	179.4	-5.9	0	0	0	109.4	F76 T81 T82	F76-D79 PolarHBondContact O-N 3.43Å; F76-D79 VanDerWaalsContact O-N 3.12Å; D79-T81 PolarHBondContact O-N 3.36Å; D79-T81 VanDerWaalsContact O-N 3.11Å; D79-T81 WeakPolarHBondContact OD1-CB 3.41Å; D79-T81 WeakPolarHBondContact OD1-CG2 3.36Å; D79-T81 PolarHBondContact OD1-N 3.19Å; D79-T81 PolarHBondContact OD1-OG1 2.97Å; D79-T81 PolarHBondContact OD2-OG1 3.46Å; D79-T82 HydrophobicContact CB-CG2 3.67Å; D79-T82 PolarHBondContact O-N 3.19Å; D79-T82 PolarHBondContact O-OG1 3.35Å
80	P	82.7	Confident	90.8	Very high	129 Å²	129	82.9 Å²	82.9	84%	0.838	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-15.5	-178.5	28.5	-36.4	0	0	0	113.3	K78 T82	K78-P80 WeakPolarHBondContact O-CD 3.01Å; P80-T82 VanDerWaalsContact C-N 3.34Å
81	T	86.4	Confident	90.8	Very high	120 Å²	120	85 Å²	85	74%	0.736	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.6	-17.8	175.9	73.2	0	0	0	0	112.6	D79	D79-T81 PolarHBondContact O-N 3.36Å; D79-T81 VanDerWaalsContact O-N 3.11Å; D79-T81 WeakPolarHBondContact OD1-CB 3.41Å; D79-T81 WeakPolarHBondContact OD1-CG2 3.36Å; D79-T81 PolarHBondContact OD1-N 3.19Å; D79-T81 PolarHBondContact OD1-OG1 2.97Å; D79-T81 PolarHBondContact OD2-OG1 3.46Å
82	T	84.6	Confident	90.8	Very high	58 Å²	58	88 Å²	88	36%	0.356	46%	0.461	S	S	.	.	S	Bend	trans	-80.1	134.2	-176.4	64.6	0	0	0	0	111.5	F76 D79 P80 K84	F76-T82 HydrophobicContact CB-CG2 4.11Å; F76-T82 PolarHBondContact O-OG1 2.86Å; D79-T82 HydrophobicContact CB-CG2 3.67Å; D79-T82 PolarHBondContact O-N 3.19Å; D79-T82 PolarHBondContact O-OG1 3.35Å; P80-T82 VanDerWaalsContact C-N 3.34Å; T82-K84 PolarHBondContact O-N 3.08Å
83	R	89.3	Confident	90.9	Very high	234 Å²	234	87.9 Å²	87.9	88%	0.883	46%	0.46	S	S	*	.	P	Polyproline II helix	trans	-65.7	130.2	178.9	-173.8	179.4	-180	-169.8	1.8	110.3	L85	R83-L85 PolarHBondContact O-N 2.91Å
84	K	91.8	Very high	91.1	Very high	138 Å²	138	85.9 Å²	85.9	60%	0.6	45%	0.449	S	S	*	.	P	Polyproline II helix	trans	-56.6	121.8	174.6	-176.9	164.1	176.9	145.7	0	111.9	E68 T82	E68-K84 WeakPolarHBondContact OE2-CE 3.36Å; E68-K84 IonicContact OE2-NZ 3.71Å; E68-K84 PolarHBondContact OE2-NZ 3.28Å; T82-K84 PolarHBondContact O-N 3.08Å
85	L	92.9	Very high	91.3	Very high	68 Å²	68	92.7 Å²	92.7	36%	0.356	47%	0.474	S	S	.	.	P	Polyproline II helix	trans	-69.9	145.7	176.1	-62.1	-176	0	0	0	112.1	R71 M74 R83 F93	R71-L85 PolarHBondContact NE-O 3.19Å; R71-L85 PolarHBondContact NH2-O 3.15Å; M74-L85 HydrophobicContact CE-CD1 3.65Å; R83-L85 PolarHBondContact O-N 2.91Å; L85-F93 HydrophobicContact CD1-CB 4.43Å; L85-F93 HydrophobicContact CD1-CG 4.45Å
86	S	96	Very high	91.6	Very high	64 Å²	64	94.1 Å²	94.1	45%	0.448	48%	0.479	S	S	.	.	P	Polyproline II helix	trans	-61.8	162.2	172.5	87.2	0	0	0	0	111.5	V88 S89 T90	S86-V88 VanDerWaalsContact C-N 3.35Å; S86-V88 PolarHBondContact O-N 3.31Å; S86-S89 PolarHBondContact O-N 3.01Å; S86-S89 VanDerWaalsContact OG-CB 3.31Å; S86-S89 WeakPolarHBondContact OG-CB 3.5Å; S86-S89 PolarHBondContact OG-N 3.19Å; S86-S89 PolarHBondContact OG-OG 3.41Å; S86-T90 WeakPolarHBondContact O-CB 3.46Å; S86-T90 PolarHBondContact O-N 3.38Å; S86-T90 PolarHBondContact O-OG1 2.88Å
87	K	96.8	Very high	92.2	Very high	99 Å²	99	90.1 Å²	90.1	43%	0.43	46%	0.46	S	S	.	.	H	α-helix	trans	-56.6	-47.6	178.3	-71.1	-172.9	175.5	-171.5	0	112	N64 M67 T90 L91	N64-K87 VanDerWaalsContact OD1-CE 3.26Å; N64-K87 WeakPolarHBondContact OD1-CE 3.49Å; N64-K87 PolarHBondContact OD1-NZ 3.22Å; M67-K87 HydrophobicContact CE-CB 4.12Å; M67-K87 HydrophobicContact CE-CG 4.21Å; K87-T90 PolarHBondContact O-N 3.01Å; K87-L91 WeakPolarHBondContact O-CG 3.47Å; K87-L91 PolarHBondContact O-N 2.72Å
88	V	97	Very high	92.9	Very high	105 Å²	105	94.3 Å²	94.3	64%	0.636	48%	0.477	S	S	*	.	H	α-helix	trans	-65.1	-45	179.1	178.6	0	0	0	0	110.5	S86 T90 L91 V92	S86-V88 VanDerWaalsContact C-N 3.35Å; S86-V88 PolarHBondContact O-N 3.31Å; V88-T90 PolarHBondContact O-N 2.75Å; V88-L91 PolarHBondContact O-N 2.69Å; V88-V92 HydrophobicContact CG1-CG2 4.42Å; V88-V92 WeakPolarHBondContact O-CG2 3.02Å; V88-V92 PolarHBondContact O-N 2.79Å
89	S	95.9	Very high	93.6	Very high	55 Å²	55	91 Å²	91	39%	0.385	47%	0.466	S	S	.	.	H	α-helix	trans	-61.5	-41.5	178.7	-53.6	0	0	0	0	112.3	S86 L91 V92 F93	S86-S89 PolarHBondContact O-N 3.01Å; S86-S89 VanDerWaalsContact OG-CB 3.31Å; S86-S89 WeakPolarHBondContact OG-CB 3.5Å; S86-S89 PolarHBondContact OG-N 3.19Å; S86-S89 PolarHBondContact OG-OG 3.41Å; S89-L91 VanDerWaalsContact C-N 3.34Å; S89-L91 PolarHBondContact O-N 2.9Å; S89-V92 PolarHBondContact O-N 2.92Å; S89-F93 VanDerWaalsContact O-CB 3.26Å; S89-F93 WeakPolarHBondContact O-CB 3.39Å; S89-F93 PolarHBondContact O-N 3.08Å
90	T	96.1	Very high	94.1	Very high	0 Å²	0	91.3 Å²	91.3	0%	0	47%	0.471	C	S	.	.	H	α-helix	trans	-60.4	-42.6	175.4	-61.4	0	0	0	0	111.5	M67 L70 R71 M74 S86 K87 V88 A94	M67-T90 HydrophobicContact CE-CG2 3.9Å; L70-T90 HydrophobicContact CD2-CG2 3.88Å; L70-T90 HydrophobicContact CG-CG2 4.1Å; R71-T90 HydrophobicContact CG-CG2 4Å; R71-T90 PolarHBondContact NE-OG1 3.11Å; M74-T90 HydrophobicContact CE-CG2 4.06Å; M74-T90 HydrophobicContact SD-CG2 4.12Å; S86-T90 WeakPolarHBondContact O-CB 3.46Å; S86-T90 PolarHBondContact O-N 3.38Å; S86-T90 PolarHBondContact O-OG1 2.88Å; K87-T90 PolarHBondContact O-N 3.01Å; V88-T90 PolarHBondContact O-N 2.75Å; T90-A94 VanDerWaalsContact O-CB 3.25Å; T90-A94 WeakPolarHBondContact O-CB 3.47Å; T90-A94 PolarHBondContact O-N 3.18Å
91	L	97.8	Very high	94.7	Very high	100 Å²	100	88.7 Å²	88.7	52%	0.524	45%	0.449	S	S	.	.	H	α-helix	trans	-67.4	-44.6	179.6	-66.1	173.7	0	0	0	112.2	M67 K87 V88 S89 A94 R95	M67-L91 HydrophobicContact CE-CD2 4.47Å; M67-L91 HydrophobicContact CE-CG 4.4Å; M67-L91 HydrophobicContact SD-CD2 4.29Å; K87-L91 WeakPolarHBondContact O-CG 3.47Å; K87-L91 PolarHBondContact O-N 2.72Å; V88-L91 PolarHBondContact O-N 2.69Å; S89-L91 VanDerWaalsContact C-N 3.34Å; S89-L91 PolarHBondContact O-N 2.9Å; L91-A94 PolarHBondContact O-N 2.97Å; L91-R95 PolarHBondContact O-N 3.46Å
92	V	95.8	Very high	95.2	Very high	80 Å²	80	86.1 Å²	86.1	49%	0.485	43%	0.434	S	S	.	.	H	α-helix	trans	-62.1	-45.4	176.6	174	0	0	0	0	110.7	V88 S89 R95 N96	V88-V92 HydrophobicContact CG1-CG2 4.42Å; V88-V92 WeakPolarHBondContact O-CG2 3.02Å; V88-V92 PolarHBondContact O-N 2.79Å; S89-V92 PolarHBondContact O-N 2.92Å; V92-R95 PolarHBondContact O-N 2.72Å; V92-N96 PolarHBondContact O-N 2.93Å; V92-N96 VanDerWaalsContact O-N 3.14Å
93	F	95.1	Very high	95.8	Very high	75 Å²	75	88.9 Å²	88.9	33%	0.329	44%	0.442	S	S	.	.	H	α-helix	trans	-63.6	-45.5	178.7	-170.5	-80.5	0	0	0	111.8	M74 P75 L85 S89 R95 N96 Y97	M74-F93 HydrophobicContact CB-CD1 4.15Å; M74-F93 HydrophobicContact CB-CE1 3.86Å; M74-F93 HydrophobicContact CE-CD1 3.98Å; M74-F93 HydrophobicContact CE-CE1 4.5Å; M74-F93 HydrophobicContact CE-CG 4.46Å; M74-F93 HydrophobicContact CG-CD1 3.93Å; M74-F93 HydrophobicContact CG-CE1 4.12Å; M74-F93 HydrophobicContact SD-CB 4.1Å; M74-F93 HydrophobicContact SD-CD1 3.28Å; M74-F93 WeakPolarHBondContact SD-CD1 3.26Å; M74-F93 HydrophobicContact SD-CE1 4.01Å; M74-F93 HydrophobicContact SD-CG 4.04Å; P75-F93 HydrophobicContact CB-CZ 4.48Å; P75-F93 HydrophobicContact CG-CE1 4.49Å; L85-F93 HydrophobicContact CD1-CB 4.43Å; L85-F93 HydrophobicContact CD1-CG 4.45Å; S89-F93 VanDerWaalsContact O-CB 3.26Å; S89-F93 WeakPolarHBondContact O-CB 3.39Å; S89-F93 PolarHBondContact O-N 3.08Å; F93-R95 VanDerWaalsContact C-N 3.32Å; F93-R95 PolarHBondContact O-N 3.22Å; F93-N96 PolarHBondContact O-N 3.3Å; F93-Y97 WeakPolarHBondContact O-CB 3.33Å; F93-Y97 PolarHBondContact O-N 3.29Å
94	A	97.5	Very high	96.1	Very high	12 Å²	12	80.7 Å²	80.7	10%	0.099	42%	0.421	C	S	.	.	H	α-helix	trans	-59.7	-41.9	177.8	0	0	0	0	0	112.1	L70 M74 T90 L91 Y97 I98	L70-A94 HydrophobicContact CD1-CB 4.09Å; L70-A94 HydrophobicContact CD2-CB 4.09Å; L70-A94 HydrophobicContact CG-CB 4.38Å; M74-A94 HydrophobicContact SD-CB 4.31Å; T90-A94 VanDerWaalsContact O-CB 3.25Å; T90-A94 WeakPolarHBondContact O-CB 3.47Å; T90-A94 PolarHBondContact O-N 3.18Å; L91-A94 PolarHBondContact O-N 2.97Å; A94-Y97 PolarHBondContact O-N 2.96Å; A94-I98 WeakPolarHBondContact O-CG1 3.15Å; A94-I98 PolarHBondContact O-N 3.07Å
95	R	97.5	Very high	96.4	Very high	154 Å²	154	79.2 Å²	79.2	58%	0.581	42%	0.419	S	S	*	.	H	α-helix	trans	-57.5	-51.8	174.3	178	-172.9	176.1	-80.8	-0.3	111.3	L91 V92 F93 Y97 I98 L99	L91-R95 PolarHBondContact O-N 3.46Å; V92-R95 PolarHBondContact O-N 2.72Å; F93-R95 VanDerWaalsContact C-N 3.32Å; F93-R95 PolarHBondContact O-N 3.22Å; R95-Y97 VanDerWaalsContact C-N 3.31Å; R95-Y97 PolarHBondContact O-N 3.44Å; R95-I98 PolarHBondContact O-N 3.1Å; R95-L99 HydrophobicContact CG-CD1 4.48Å; R95-L99 WeakPolarHBondContact O-CG 3.43Å; R95-L99 PolarHBondContact O-N 2.87Å; R95-L99 VanDerWaalsContact O-N 3.17Å
96	N	95.2	Very high	96.5	Very high	76 Å²	76	80 Å²	80	41%	0.406	42%	0.421	S	S	.	.	H	α-helix	trans	-65.9	-37.2	-177.9	-68	-12.2	0	0	0	111.4	V92 F93 I98 L99 T100	V92-N96 PolarHBondContact O-N 2.93Å; V92-N96 VanDerWaalsContact O-N 3.14Å; F93-N96 PolarHBondContact O-N 3.3Å; N96-I98 PolarHBondContact O-N 3.38Å; N96-L99 PolarHBondContact O-N 3.46Å; N96-T100 PolarHBondContact O-N 2.81Å; N96-T100 PolarHBondContact O-OG1 3.48Å
97	Y	97.6	Very high	96.5	Very high	76 Å²	76	80 Å²	80	30%	0.298	42%	0.416	S	S	.	.	H	α-helix	trans	-62.3	-43.7	176.5	-177.8	-134.1	0	0	0	112.2	P75 F93 A94 R95 L99 T100 L101	P75-Y97 VanDerWaalsContact CD-CE1 3.47Å; P75-Y97 HydrophobicContact CG-CD1 4.5Å; P75-Y97 HydrophobicContact CG-CD2 3.71Å; P75-Y97 HydrophobicContact CG-CE1 4.18Å; P75-Y97 HydrophobicContact CG-CE2 3.33Å; P75-Y97 HydrophobicContact CG-CG 4.29Å; F93-Y97 WeakPolarHBondContact O-CB 3.33Å; F93-Y97 PolarHBondContact O-N 3.29Å; A94-Y97 PolarHBondContact O-N 2.96Å; R95-Y97 VanDerWaalsContact C-N 3.31Å; R95-Y97 PolarHBondContact O-N 3.44Å; Y97-L99 VanDerWaalsContact C-N 3.34Å; Y97-L99 PolarHBondContact O-N 2.92Å; Y97-T100 PolarHBondContact O-N 3.29Å; Y97-L101 HydrophobicContact CD1-CD1 4.23Å; Y97-L101 HydrophobicContact CD2-CD1 4.23Å; Y97-L101 HydrophobicContact CD2-CG 4.05Å; Y97-L101 HydrophobicContact CE1-CD1 3.77Å; Y97-L101 HydrophobicContact CE2-CD1 3.76Å; Y97-L101 HydrophobicContact CE2-CD2 3.81Å; Y97-L101 HydrophobicContact CE2-CG 3.67Å; Y97-L101 HydrophobicContact CG-CD1 4.44Å; Y97-L101 WeakPolarHBondContact O-CG 3.4Å; Y97-L101 PolarHBondContact O-N 3.33Å
98	I	97.4	Very high	96.4	Very high	107 Å²	107	77.7 Å²	77.7	55%	0.549	42%	0.415	S	S	.	.	H	α-helix	trans	-57.9	-47.2	173.7	-68.1	165.2	0	0	0	110.6	A94 R95 N96 T100 L101 T102	A94-I98 WeakPolarHBondContact O-CG1 3.15Å; A94-I98 PolarHBondContact O-N 3.07Å; R95-I98 PolarHBondContact O-N 3.1Å; N96-I98 PolarHBondContact O-N 3.38Å; I98-T100 PolarHBondContact O-N 2.94Å; I98-L101 PolarHBondContact O-N 3Å; I98-T102 PolarHBondContact O-N 3.05Å; I98-T102 PolarHBondContact O-OG1 3.41Å; I98-T102 VanDerWaalsContact O-OG1 3.11Å
99	L	96	Very high	96.3	Very high	89 Å²	89	79.2 Å²	79.2	47%	0.466	41%	0.413	S	S	.	.	H	α-helix	trans	-59.7	-47.7	179.4	-68.3	173.3	0	0	0	112.4	R95 N96 Y97 L101 T102 E103	R95-L99 HydrophobicContact CG-CD1 4.48Å; R95-L99 WeakPolarHBondContact O-CG 3.43Å; R95-L99 PolarHBondContact O-N 2.87Å; R95-L99 VanDerWaalsContact O-N 3.17Å; N96-L99 PolarHBondContact O-N 3.46Å; Y97-L99 VanDerWaalsContact C-N 3.34Å; Y97-L99 PolarHBondContact O-N 2.92Å; L99-L101 VanDerWaalsContact C-N 3.33Å; L99-L101 PolarHBondContact O-N 3.42Å; L99-T102 PolarHBondContact O-N 2.93Å; L99-E103 PolarHBondContact O-N 3.46Å
100	T	96.1	Very high	96.2	Very high	79 Å²	79	82.3 Å²	82.3	49%	0.485	42%	0.417	S	S	.	.	H	α-helix	trans	-60.7	-41.5	177.9	-58.6	0	0	0	0	112	N96 Y97 I98 S104	N96-T100 PolarHBondContact O-N 2.81Å; N96-T100 PolarHBondContact O-OG1 3.48Å; Y97-T100 PolarHBondContact O-N 3.29Å; I98-T100 PolarHBondContact O-N 2.94Å; T100-S104 WeakPolarHBondContact O-CB 3.3Å; T100-S104 PolarHBondContact O-N 3.36Å; T100-S104 PolarHBondContact O-OG 3.44Å
101	L	96	Very high	96	Very high	73 Å²	73	87.7 Å²	87.7	38%	0.382	44%	0.444	S	S	.	.	H	α-helix	trans	-65.5	-43.4	177	-71.6	178.7	0	0	0	111.8	Y97 I98 L99 S104 L105	Y97-L101 HydrophobicContact CD1-CD1 4.23Å; Y97-L101 HydrophobicContact CD2-CD1 4.23Å; Y97-L101 HydrophobicContact CD2-CG 4.05Å; Y97-L101 HydrophobicContact CE1-CD1 3.77Å; Y97-L101 HydrophobicContact CE2-CD1 3.76Å; Y97-L101 HydrophobicContact CE2-CD2 3.81Å; Y97-L101 HydrophobicContact CE2-CG 3.67Å; Y97-L101 HydrophobicContact CG-CD1 4.44Å; Y97-L101 WeakPolarHBondContact O-CG 3.4Å; Y97-L101 PolarHBondContact O-N 3.33Å; I98-L101 PolarHBondContact O-N 3Å; L99-L101 VanDerWaalsContact C-N 3.33Å; L99-L101 PolarHBondContact O-N 3.42Å; L101-S104 PolarHBondContact O-N 3.45Å; L101-L105 VanDerWaalsContact O-CG 3.31Å; L101-L105 WeakPolarHBondContact O-CG 3.34Å; L101-L105 PolarHBondContact O-N 3.01Å
102	T	97.2	Very high	95.7	Very high	67 Å²	67	88.1 Å²	88.1	41%	0.411	45%	0.445	S	S	.	.	H	α-helix	trans	-60.4	-48.1	177.1	-62.2	0	0	0	0	111.2	I98 L99 S104 L105 E106	I98-T102 PolarHBondContact O-N 3.05Å; I98-T102 PolarHBondContact O-OG1 3.41Å; I98-T102 VanDerWaalsContact O-OG1 3.11Å; L99-T102 PolarHBondContact O-N 2.93Å; T102-S104 VanDerWaalsContact C-N 3.34Å; T102-S104 PolarHBondContact O-N 3.34Å; T102-L105 PolarHBondContact O-N 3.42Å; T102-E106 WeakPolarHBondContact O-CG 3.26Å; T102-E106 PolarHBondContact O-N 3.4Å
103	E	96.2	Very high	95.4	Very high	115 Å²	115	90 Å²	90	54%	0.537	45%	0.452	S	S	.	.	H	α-helix	trans	-60	-43.5	176.7	-175.7	-178.3	-176.5	0	0	111.8	L99 L105 E106 N107	L99-E103 PolarHBondContact O-N 3.46Å; E103-L105 VanDerWaalsContact C-N 3.35Å; E103-L105 PolarHBondContact O-N 3.48Å; E103-E106 PolarHBondContact O-N 3.09Å; E103-N107 WeakPolarHBondContact O-CB 3.41Å; E103-N107 VanDerWaalsContact O-CG 3.25Å; E103-N107 PolarHBondContact O-N 3.13Å; E103-N107 PolarHBondContact O-ND2 2.83Å
104	S	97.1	Very high	95.1	Very high	62 Å²	62	92.1 Å²	92.1	43%	0.434	46%	0.463	S	S	.	.	H	α-helix	trans	-61.7	-41.4	177.5	-59.5	0	0	0	0	112.1	T100 L101 T102 N107 A108	T100-S104 WeakPolarHBondContact O-CB 3.3Å; T100-S104 PolarHBondContact O-N 3.36Å; T100-S104 PolarHBondContact O-OG 3.44Å; L101-S104 PolarHBondContact O-N 3.45Å; T102-S104 VanDerWaalsContact C-N 3.34Å; T102-S104 PolarHBondContact O-N 3.34Å; S104-N107 PolarHBondContact O-N 3.22Å; S104-A108 WeakPolarHBondContact O-CB 3.37Å; S104-A108 PolarHBondContact O-N 2.97Å
105	L	97.5	Very high	94.2	Very high	108 Å²	108	94 Å²	94	57%	0.565	48%	0.475	S	S	*	.	H	α-helix	trans	-67.8	-39.3	176.6	-71.8	174.5	0	0	0	112.2	L101 T102 E103 K109	L101-L105 VanDerWaalsContact O-CG 3.31Å; L101-L105 WeakPolarHBondContact O-CG 3.34Å; L101-L105 PolarHBondContact O-N 3.01Å; T102-L105 PolarHBondContact O-N 3.42Å; E103-L105 VanDerWaalsContact C-N 3.35Å; E103-L105 PolarHBondContact O-N 3.48Å; L105-K109 VanDerWaalsContact O-CG 3.28Å; L105-K109 WeakPolarHBondContact O-CG 3.49Å; L105-K109 PolarHBondContact O-N 3.44Å
106	E	95.8	Very high	93	Very high	84 Å²	84	92.7 Å²	92.7	39%	0.393	48%	0.475	S	S	.	.	H	α-helix	trans	-65	-43.4	174.2	-72.4	-179.5	-167	0	0	112.1	T102 E103 K109 R110	T102-E106 WeakPolarHBondContact O-CG 3.26Å; T102-E106 PolarHBondContact O-N 3.4Å; E103-E106 PolarHBondContact O-N 3.09Å; E106-K109 WeakPolarHBondContact O-CB 3.43Å; E106-K109 PolarHBondContact O-N 2.89Å; E106-R110 WeakPolarHBondContact O-CG 3.46Å; E106-R110 PolarHBondContact O-N 2.78Å; E106-R110 IonicContact OE2-CZ 2.72Å; E106-R110 IonicContact OE2-NH1 3.27Å; E106-R110 IonicContact OE2-NH2 2.9Å; E106-R110 PolarHBondContact OE2-NH2 3.37Å
107	N	94.8	Very high	91.5	Very high	63 Å²	63	95 Å²	95	34%	0.337	48%	0.483	S	S	.	.	H	α-helix	trans	-63.4	-43.7	177.2	-71.8	-18.1	0	0	0	111.4	E103 S104 K109 R110 I111	E103-N107 WeakPolarHBondContact O-CB 3.41Å; E103-N107 VanDerWaalsContact O-CG 3.25Å; E103-N107 PolarHBondContact O-N 3.13Å; E103-N107 PolarHBondContact O-ND2 2.83Å; S104-N107 PolarHBondContact O-N 3.22Å; N107-K109 VanDerWaalsContact C-N 3.32Å; N107-K109 PolarHBondContact O-N 3.31Å; N107-R110 PolarHBondContact O-N 2.87Å; N107-R110 PolarHBondContact OD1-NH1 3.46Å; N107-I111 WeakPolarHBondContact O-CG1 3.45Å; N107-I111 PolarHBondContact O-N 3.18Å
108	A	94.5	Very high	89.6	Confident	51 Å²	51	98 Å²	98	42%	0.421	50%	0.5	S	S	.	.	H	α-helix	trans	-59.5	-41.5	173.7	0	0	0	0	0	112.1	S104 M112	S104-A108 WeakPolarHBondContact O-CB 3.37Å; S104-A108 PolarHBondContact O-N 2.97Å; A108-M112 WeakPolarHBondContact O-CB 3.42Å; A108-M112 PolarHBondContact O-N 2.87Å
109	K	94.5	Very high	87.6	Confident	137 Å²	137	100.7 Å²	100.7	60%	0.596	51%	0.51	S	S	*	.	H	α-helix	trans	-63.5	-43.9	173.7	-73.9	172.9	-177.7	-179.8	0	112.2	L105 E106 N107 M112 L113	L105-K109 VanDerWaalsContact O-CG 3.28Å; L105-K109 WeakPolarHBondContact O-CG 3.49Å; L105-K109 PolarHBondContact O-N 3.44Å; E106-K109 WeakPolarHBondContact O-CB 3.43Å; E106-K109 PolarHBondContact O-N 2.89Å; N107-K109 VanDerWaalsContact C-N 3.32Å; N107-K109 PolarHBondContact O-N 3.31Å; K109-M112 PolarHBondContact O-N 3Å; K109-L113 VanDerWaalsContact O-CG 3.31Å; K109-L113 WeakPolarHBondContact O-CG 3.33Å; K109-L113 PolarHBondContact O-N 3.13Å
110	R	93.7	Very high	85.6	Confident	120 Å²	120	100.8 Å²	100.8	45%	0.453	52%	0.518	S	S	.	.	H	α-helix	trans	-60.7	-47.2	177.4	-72.7	178.7	-169.4	107.1	10.1	111.5	E106 N107 M112 L113 Q114	E106-R110 WeakPolarHBondContact O-CG 3.46Å; E106-R110 PolarHBondContact O-N 2.78Å; E106-R110 IonicContact OE2-CZ 2.72Å; E106-R110 IonicContact OE2-NH1 3.27Å; E106-R110 IonicContact OE2-NH2 2.9Å; E106-R110 PolarHBondContact OE2-NH2 3.37Å; N107-R110 PolarHBondContact O-N 2.87Å; N107-R110 PolarHBondContact OD1-NH1 3.46Å; R110-M112 VanDerWaalsContact C-N 3.31Å; R110-M112 PolarHBondContact O-N 3.36Å; R110-L113 PolarHBondContact O-N 2.92Å; R110-Q114 WeakPolarHBondContact O-CB 3.45Å; R110-Q114 VanDerWaalsContact O-CG 3.27Å; R110-Q114 WeakPolarHBondContact O-CG 3.3Å; R110-Q114 PolarHBondContact O-N 2.93Å
111	I	93.3	Very high	83.5	Confident	113 Å²	113	104.5 Å²	104.5	58%	0.579	52%	0.524	S	S	*	.	H	α-helix	trans	-60.3	-43.6	177.6	-67.4	165.8	0	0	0	110.5	N107 Q114 S115	N107-I111 WeakPolarHBondContact O-CG1 3.45Å; N107-I111 PolarHBondContact O-N 3.18Å; I111-Q114 PolarHBondContact O-N 3.04Å; I111-S115 PolarHBondContact O-N 3.4Å
112	M	90.4	Very high	81.3	Confident	110 Å²	110	107.9 Å²	107.9	54%	0.542	54%	0.543	S	S	.	.	H	α-helix	trans	-62.3	-45.5	176.5	-169.5	-174.1	-48.3	0	0	111.7	A108 K109 R110 Q114 S115 H116	A108-M112 WeakPolarHBondContact O-CB 3.42Å; A108-M112 PolarHBondContact O-N 2.87Å; K109-M112 PolarHBondContact O-N 3Å; R110-M112 VanDerWaalsContact C-N 3.31Å; R110-M112 PolarHBondContact O-N 3.36Å; M112-Q114 VanDerWaalsContact C-N 3.33Å; M112-Q114 PolarHBondContact O-N 3.27Å; M112-S115 PolarHBondContact O-N 3.19Å; M112-S115 PolarHBondContact O-OG 3.04Å; M112-H116 PolarHBondContact O-N 3.09Å; M112-H116 PolarHBondContact O-ND1 3.38Å
113	L	90.8	Very high	78.9	Confident	119 Å²	119	108.4 Å²	108.4	62%	0.623	56%	0.562	S	S	*	*	H	α-helix	trans	-64.5	-37.9	177.3	-68.8	170.7	0	0	0	112.2	K109 R110 H116 H117	K109-L113 VanDerWaalsContact O-CG 3.31Å; K109-L113 WeakPolarHBondContact O-CG 3.33Å; K109-L113 PolarHBondContact O-N 3.13Å; R110-L113 PolarHBondContact O-N 2.92Å; L113-H116 PolarHBondContact O-N 3.49Å; L113-H117 PolarHBondContact O-N 3.01Å
114	Q	87.9	Confident	76.5	Confident	120 Å²	120	109.4 Å²	109.4	56%	0.561	57%	0.571	S	S	*	*	H	α-helix	trans	-65.6	-40.2	175.1	-71.9	171.6	0.9	0	0	111.8	R110 I111 M112 H116 H117 H118	R110-Q114 WeakPolarHBondContact O-CB 3.45Å; R110-Q114 VanDerWaalsContact O-CG 3.27Å; R110-Q114 WeakPolarHBondContact O-CG 3.3Å; R110-Q114 PolarHBondContact O-N 2.93Å; I111-Q114 PolarHBondContact O-N 3.04Å; M112-Q114 VanDerWaalsContact C-N 3.33Å; M112-Q114 PolarHBondContact O-N 3.27Å; Q114-H116 VanDerWaalsContact C-N 3.31Å; Q114-H116 PolarHBondContact O-N 2.97Å; Q114-H117 PolarHBondContact O-N 3.42Å; Q114-H118 PolarHBondContact O-CD2 3.35Å; Q114-H118 VanDerWaalsContact O-CD2 3.28Å; Q114-H118 PolarHBondContact O-N 3.08Å
115	S	79.6	Confident	74.1	Confident	52 Å²	52	113.6 Å²	113.6	36%	0.364	59%	0.587	S	S	.	*	H	α-helix	trans	-66.4	-31.3	179	68.7	0	0	0	0	113.2	I111 M112 H118 Q119	I111-S115 PolarHBondContact O-N 3.4Å; M112-S115 PolarHBondContact O-N 3.19Å; M112-S115 PolarHBondContact O-OG 3.04Å; S115-H118 PolarHBondContact O-N 3.21Å; S115-Q119 PolarHBondContact O-N 3.34Å
116	H	71.1	Confident	71.7	Confident	125 Å²	125	115.9 Å²	115.9	58%	0.579	60%	0.599	S	S	*	*	H	α-helix	trans	-68.9	-32.9	175.6	-73.5	77.5	0	0	0	112.2	M112 L113 Q114	M112-H116 PolarHBondContact O-N 3.09Å; M112-H116 PolarHBondContact O-ND1 3.38Å; L113-H116 PolarHBondContact O-N 3.49Å; Q114-H116 VanDerWaalsContact C-N 3.31Å; Q114-H116 PolarHBondContact O-N 2.97Å
117	H	64.3	Low	69.7	Low	125 Å²	125	118.1 Å²	118.1	58%	0.579	62%	0.619	S	S	*	*	H	α-helix	trans	-70.9	-39.7	173	-82.2	-64.1	0	0	0	112.3	L113 Q114 Q119 S120 Y121	L113-H117 PolarHBondContact O-N 3.01Å; Q114-H117 PolarHBondContact O-N 3.42Å; H117-Q119 VanDerWaalsContact C-N 3.33Å; H117-Q119 PolarHBondContact O-N 3.25Å; H117-S120 PolarHBondContact O-N 3.39Å; H117-Y121 WeakPolarHBondContact O-CD2 3.4Å; H117-Y121 WeakPolarHBondContact O-CE2 3.36Å
118	H	56.9	Low	67.8	Low	139 Å²	139	119.7 Å²	119.7	64%	0.644	63%	0.632	S	S	*	*	H	α-helix	trans	-71.7	-19	-179.2	-77.3	-75	0	0	0	115.1	Q114 S115 S120	Q114-H118 PolarHBondContact O-CD2 3.35Å; Q114-H118 VanDerWaalsContact O-CD2 3.28Å; Q114-H118 PolarHBondContact O-N 3.08Å; S115-H118 PolarHBondContact O-N 3.21Å; H118-S120 VanDerWaalsContact C-N 3.27Å; H118-S120 PolarHBondContact O-N 3.44Å
119	Q	56.1	Low	65.7	Low	164 Å²	164	121.5 Å²	121.5	77%	0.766	64%	0.642	S	S	*	*	G	3₁₀ helix	trans	-74.1	-14.5	173.3	-79.3	-174.1	35	0	0	113.6	S115 H117 Y121	S115-Q119 PolarHBondContact O-N 3.34Å; H117-Q119 VanDerWaalsContact C-N 3.33Å; H117-Q119 PolarHBondContact O-N 3.25Å; Q119-Y121 PolarHBondContact O-N 2.95Å
120	S	53.2	Low	64.1	Low	91 Å²	91	122.3 Å²	122.3	64%	0.636	65%	0.649	S	S	*	*	G	3₁₀ helix	trans	-86.3	1.6	-177.2	-165.1	0	0	0	0	115	H117 H118	H117-S120 PolarHBondContact O-N 3.39Å; H118-S120 VanDerWaalsContact C-N 3.27Å; H118-S120 PolarHBondContact O-N 3.44Å
121	Y	52.5	Low	62.3	Low	156 Å²	156	124.4 Å²	124.4	61%	0.612	66%	0.664	S	S	*	*	G	3₁₀ helix	trans	-133	44.9	-179.1	-31.9	-78	0	0	0	112.3	H117 Q119	H117-Y121 WeakPolarHBondContact O-CD2 3.4Å; H117-Y121 WeakPolarHBondContact O-CE2 3.36Å; Q119-Y121 PolarHBondContact O-N 2.95Å
122	N	49.9	Very low	60.3	Low	144 Å²	144	125.6 Å²	125.6	77%	0.77	68%	0.677	S	S	*	*			trans	-141.6	70.5	161.6	-86.2	-40.1	0	0	0	108.7	N124	N122-N124 PolarHBondContact O-N 2.82Å
123	G	46.4	Very low	58.5	Low	78 Å²	78	125.1 Å²	125.1	80%	0.804	68%	0.684	S	S	*	*			trans	-72.2	74.8	160.3	0	0	0	0	0	109
124	N	46.2	Very low	56.2	Low	136 Å²	136	125.3 Å²	125.3	73%	0.727	70%	0.696	S	S	*	*			trans	-171.9	119	158.8	-104.5	-11.4	0	0	0	111.5	N122	N122-N124 PolarHBondContact O-N 2.82Å
125	L	46.6	Very low	54.2	Low	150 Å²	150	125 Å²	125	79%	0.785	71%	0.706	S	S	*	*			trans	75.9	121.5	145	-68	146.2	0	0	0	119.4
126	L	48.1	Very low	52.8	Low	156 Å²	156	131 Å²	131	82%	0.817	73%	0.733	S	S	*	*			trans	88.6	90.2	148.8	-124.2	118.3	0	0	0	117.7	P128	L126-P128 VanDerWaalsContact O-CD 3.31Å; L126-P128 WeakPolarHBondContact O-CD 3.23Å
127	V	53.2	Low	51.9	Low	132 Å²	132	133 Å²	133	80%	0.8	74%	0.742	S	S	*	*			trans	-57.8	121.1	158.8	175.2	0	0	0	0	109.8
128	P	54.2	Low	51.1	Low	95 Å²	95	132.4 Å²	132.4	62%	0.617	75%	0.749	S	S	*	*			trans	-92.1	107.3	157.6	9.4	11	0	0	0	107.9	L126 M130	L126-P128 VanDerWaalsContact O-CD 3.31Å; L126-P128 WeakPolarHBondContact O-CD 3.23Å; P128-M130 HydrophobicContact CB-CG 4.38Å; P128-M130 PolarHBondContact O-N 2.96Å; P128-M130 VanDerWaalsContact O-N 3.08Å
129	S	50.1	Low	50.9	Low	89 Å²	89	131.3 Å²	131.3	62%	0.622	75%	0.753	S	S	*	*			trans	-56.7	106.8	163.2	-179.9	0	0	0	0	108.5
130	M	61	Low	50.9	Low	154 Å²	154	129.1 Å²	129.1	76%	0.759	75%	0.751	S	S	*	*			trans	-112.8	115.7	175	-64.4	-82	93.4	0	0	108	P128	P128-M130 HydrophobicContact CB-CG 4.38Å; P128-M130 PolarHBondContact O-N 2.96Å; P128-M130 VanDerWaalsContact O-N 3.08Å
131	H	56.2	Low	51.1	Low	164 Å²	164	129.8 Å²	129.8	76%	0.759	75%	0.747	S	S	*	*			trans	-58.1	131.7	-172.8	-70.1	-111.6	0	0	0	111.8	S133	H131-S133 PolarHBondContact O-N 2.97Å
132	T	52.6	Low	51.4	Low	139 Å²	139	126.4 Å²	126.4	85%	0.853	74%	0.744	S	S	*	*			trans	-61.8	99.5	171.2	50.7	0	0	0	0	109.8
133	S	51.8	Low	51.7	Low	99 Å²	99	126.1 Å²	126.1	69%	0.692	74%	0.742	S	S	*	*			trans	-118.8	90.9	166.5	-69.3	0	0	0	0	109.5	H131 C135	H131-S133 PolarHBondContact O-N 2.97Å; S133-C135 PolarHBondContact O-N 3.39Å
134	S	43.3	Very low	52	Low	124 Å²	124	124.8 Å²	124.8	87%	0.867	72%	0.723	S	S	*	*			trans	3	92.6	145.4	-39.8	0	0	0	0	116.2
135	C	45.4	Very low	52.6	Low	114 Å²	114	122.6 Å²	122.6	77%	0.77	72%	0.715	S	S	*	*			trans	-141.9	65.5	154.7	51.8	0	0	0	0	109.2	S133 Q137	S133-C135 PolarHBondContact O-N 3.39Å; C135-Q137 PolarHBondContact O-N 3.28Å
136	L	49.9	Very low	52.8	Low	178 Å²	178	120.9 Å²	120.9	93%	0.932	70%	0.698	S	S	*	*			trans	-70.4	81.7	163.4	-70.4	171.2	0	0	0	108.1
137	Q	52.9	Low	53.1	Low	165 Å²	165	117.4 Å²	117.4	77%	0.771	69%	0.687	S	S	*	*			trans	-79.3	126.9	159.3	-67.4	-153.4	-51.3	0	0	108	C135 T139	C135-Q137 PolarHBondContact O-N 3.28Å; Q137-T139 PolarHBondContact O-N 3.49Å
138	P	47.1	Very low	53.3	Low	113 Å²	113	118.1 Å²	118.1	73%	0.734	68%	0.682	S	S	*	*			trans	-67.2	102.8	170.5	27.7	-28.6	0	0	0	106.7	V140	P138-V140 PolarHBondContact O-N 3.49Å
139	T	52.5	Low	53.6	Low	116 Å²	116	118.4 Å²	118.4	71%	0.712	68%	0.677	S	S	*	*			trans	-62	94.5	162	-74.6	0	0	0	0	106	Q137 N141	Q137-T139 PolarHBondContact O-N 3.49Å; T139-N141 VanDerWaalsContact C-N 3.28Å; T139-N141 PolarHBondContact O-N 3.42Å
140	V	56.1	Low	54.2	Low	119 Å²	119	119.8 Å²	119.8	72%	0.721	68%	0.677	S	S	*	*			trans	-62.4	95.1	168	-75	0	0	0	0	106.4	P138 P142	P138-V140 PolarHBondContact O-N 3.49Å; V140-P142 WeakPolarHBondContact O-CD 3.4Å
141	N	57.7	Low	54.1	Low	104 Å²	104	117.4 Å²	117.4	56%	0.556	67%	0.667	S	S	*	*			trans	-62.7	104.2	171.1	-84.6	-31.9	0	0	0	107.5	T139 L143 A144	T139-N141 VanDerWaalsContact C-N 3.28Å; T139-N141 PolarHBondContact O-N 3.42Å; N141-L143 PolarHBondContact O-N 2.95Å; N141-L143 VanDerWaalsContact O-N 3.15Å; N141-A144 HydrophobicContact CB-CB 4.12Å; N141-A144 PolarHBondContact O-N 3.24Å
142	P	58	Low	54.3	Low	86 Å²	86	112.7 Å²	112.7	56%	0.558	66%	0.657	S	S	*	*	H	α-helix	trans	-59.1	-36.9	-176.5	24.4	-31.7	0	0	0	109.6	V140 A144 T145 W146	V140-P142 WeakPolarHBondContact O-CD 3.4Å; P142-A144 VanDerWaalsContact C-N 3.33Å; P142-A144 PolarHBondContact O-N 3.04Å; P142-T145 PolarHBondContact O-N 3.42Å; P142-W146 PolarHBondContact O-N 3.38Å
143	L	55.7	Low	54.9	Low	138 Å²	138	112 Å²	112	72%	0.723	64%	0.643	S	S	*	*	H	α-helix	trans	-61.2	-35.1	-177.1	-165.6	67	0	0	0	114	N141 W146 S147	N141-L143 PolarHBondContact O-N 2.95Å; N141-L143 VanDerWaalsContact O-N 3.15Å; L143-W146 PolarHBondContact O-N 2.97Å; L143-S147 PolarHBondContact O-N 3.21Å; L143-S147 VanDerWaalsContact O-N 3.08Å
144	A	53	Low	54.8	Low	50 Å²	50	115.3 Å²	115.3	41%	0.413	64%	0.642	S	S	.	*	H	α-helix	trans	-70.5	-37.6	179.6	0	0	0	0	0	111.5	N141 P142 Q148	N141-A144 HydrophobicContact CB-CB 4.12Å; N141-A144 PolarHBondContact O-N 3.24Å; P142-A144 VanDerWaalsContact C-N 3.33Å; P142-A144 PolarHBondContact O-N 3.04Å; A144-Q148 PolarHBondContact O-N 2.99Å
145	T	59.6	Low	55.5	Low	90 Å²	90	115.4 Å²	115.4	55%	0.552	63%	0.629	S	S	*	*	H	α-helix	trans	-69.3	-38.3	174.2	-45.2	0	0	0	0	111.4	P142 Q148 L149	P142-T145 PolarHBondContact O-N 3.42Å; T145-Q148 PolarHBondContact O-N 2.81Å; T145-L149 WeakPolarHBondContact O-CB 3.48Å; T145-L149 PolarHBondContact O-N 2.99Å
146	W	50.3	Low	56.2	Low	113 Å²	113	114.4 Å²	114.4	43%	0.428	62%	0.616	S	S	.	*	H	α-helix	trans	-66.8	-40.1	178.6	-71	114.5	0	0	0	113.1	V73 P142 L143 Q148 L149 L150	V73-W146 HydrophobicContact CG1-CD2 4.45Å; V73-W146 HydrophobicContact CG1-CH2 4.01Å; V73-W146 HydrophobicContact CG1-CZ2 3.67Å; P142-W146 PolarHBondContact O-N 3.38Å; L143-W146 PolarHBondContact O-N 2.97Å; W146-Q148 VanDerWaalsContact C-N 3.31Å; W146-Q148 PolarHBondContact O-N 3.41Å; W146-L149 PolarHBondContact O-N 3.43Å; W146-L150 WeakPolarHBondContact O-CB 3.39Å; W146-L150 PolarHBondContact O-N 3.14Å
147	S	55.2	Low	56.4	Low	84 Å²	84	109.8 Å²	109.8	59%	0.587	59%	0.589	S	S	*	*	H	α-helix	trans	-62.1	-39.6	176.5	-173.6	0	0	0	0	112.2	L143 L151	L143-S147 PolarHBondContact O-N 3.21Å; L143-S147 VanDerWaalsContact O-N 3.08Å; S147-L151 VanDerWaalsContact O-CB 3.3Å; S147-L151 WeakPolarHBondContact O-CB 3.27Å; S147-L151 PolarHBondContact O-N 3.23Å
148	Q	56.6	Low	56.3	Low	147 Å²	147	105.2 Å²	105.2	69%	0.687	58%	0.58	S	S	*	*	H	α-helix	trans	-73.7	-41.5	-179.9	-67.7	-177.7	27.8	0	0	112	A144 T145 W146 A152	A144-Q148 PolarHBondContact O-N 2.99Å; T145-Q148 PolarHBondContact O-N 2.81Å; W146-Q148 VanDerWaalsContact C-N 3.31Å; W146-Q148 PolarHBondContact O-N 3.41Å; Q148-A152 WeakPolarHBondContact O-CB 3.35Å; Q148-A152 PolarHBondContact O-N 3.49Å
149	L	61.2	Low	56.8	Low	101 Å²	101	110.8 Å²	110.8	53%	0.529	59%	0.586	S	S	.	*	H	α-helix	trans	-69.2	-40.1	179.4	-153	94.5	0	0	0	112.1	T145 W146 A152 Q153	T145-L149 WeakPolarHBondContact O-CB 3.48Å; T145-L149 PolarHBondContact O-N 2.99Å; W146-L149 PolarHBondContact O-N 3.43Å; L149-A152 PolarHBondContact O-N 3.3Å; L149-Q153 WeakPolarHBondContact O-CB 3.42Å; L149-Q153 PolarHBondContact O-N 2.87Å
150	L	61.1	Low	56.8	Low	118 Å²	118	114.1 Å²	114.1	62%	0.618	59%	0.586	S	S	*	*	H	α-helix	trans	-69	-38.9	-179.8	-157.2	120.5	0	0	0	111.2	W146 Q153 Y154	W146-L150 WeakPolarHBondContact O-CB 3.39Å; W146-L150 PolarHBondContact O-N 3.14Å; L150-Q153 PolarHBondContact O-N 3.34Å; L150-Y154 WeakPolarHBondContact O-CB 3.35Å; L150-Y154 PolarHBondContact O-N 3.37Å
151	L	60.1	Low	56.3	Low	103 Å²	103	115.3 Å²	115.3	54%	0.539	58%	0.577	S	S	.	*	H	α-helix	trans	-67.1	-41.7	174.3	-170.1	64.1	0	0	0	111.7	S147 Q153 Y154 H155	S147-L151 VanDerWaalsContact O-CB 3.3Å; S147-L151 WeakPolarHBondContact O-CB 3.27Å; S147-L151 PolarHBondContact O-N 3.23Å; L151-Q153 VanDerWaalsContact C-N 3.33Å; L151-Q153 PolarHBondContact O-N 3.44Å; L151-Y154 PolarHBondContact O-N 3.46Å; L151-H155 PolarHBondContact O-CD2 2.96Å; L151-H155 PolarHBondContact O-N 2.89Å; L151-H155 VanDerWaalsContact O-N 3.09Å
152	A	60	Low	56.6	Low	66 Å²	66	114.8 Å²	114.8	55%	0.545	58%	0.579	S	S	.	*	H	α-helix	trans	-61.6	-40.2	175.2	0	0	0	0	0	112.3	Q148 L149 D156	Q148-A152 WeakPolarHBondContact O-CB 3.35Å; Q148-A152 PolarHBondContact O-N 3.49Å; L149-A152 PolarHBondContact O-N 3.3Å; A152-D156 PolarHBondContact O-N 3.45Å
153	Q	64.8	Low	56.5	Low	123 Å²	123	118.8 Å²	118.8	58%	0.575	60%	0.595	S	S	*	*	H	α-helix	trans	-73.6	-33.5	178.5	-169.5	153.6	-48.1	0	0	113.1	L149 L150 L151 D156 Q157	L149-Q153 WeakPolarHBondContact O-CB 3.42Å; L149-Q153 PolarHBondContact O-N 2.87Å; L150-Q153 PolarHBondContact O-N 3.34Å; L151-Q153 VanDerWaalsContact C-N 3.33Å; L151-Q153 PolarHBondContact O-N 3.44Å; Q153-D156 PolarHBondContact O-N 3.35Å; Q153-Q157 PolarHBondContact O-N 2.88Å
154	Y	50.7	Low	56.7	Low	169 Å²	169	119.3 Å²	119.3	66%	0.663	59%	0.594	S	S	*	*	H	α-helix	trans	-68.3	-37.7	176.1	-139	-95	0	0	0	112.1	L150 L151 A158	L150-Y154 WeakPolarHBondContact O-CB 3.35Å; L150-Y154 PolarHBondContact O-N 3.37Å; L151-Y154 PolarHBondContact O-N 3.46Å; Y154-A158 WeakPolarHBondContact O-CB 3.14Å; Y154-A158 PolarHBondContact O-N 3.41Å
155	H	58.5	Low	56.7	Low	127 Å²	127	122.2 Å²	122.2	59%	0.588	61%	0.609	S	S	*	*	H	α-helix	trans	-66.7	-35.3	176.1	-90.6	-78.4	0	0	0	113.2	L151	L151-H155 PolarHBondContact O-CD2 2.96Å; L151-H155 PolarHBondContact O-N 2.89Å; L151-H155 VanDerWaalsContact O-N 3.09Å
156	D	59.3	Low	56.7	Low	93 Å²	93	124.1 Å²	124.1	50%	0.497	62%	0.62	S	S	.	*	H	α-helix	trans	-72.2	-40.3	176.4	-163.5	74.7	0	0	0	112	A152 Q153 A158 R159 R160	A152-D156 PolarHBondContact O-N 3.45Å; Q153-D156 PolarHBondContact O-N 3.35Å; D156-A158 PolarHBondContact O-N 2.94Å; D156-R159 PolarHBondContact O-N 3.38Å; D156-R160 IonicContact OD2-NH1 3.63Å
157	Q	54.6	Low	56.8	Low	80 Å²	80	124.4 Å²	124.4	37%	0.374	64%	0.639	S	S	.	*	H	α-helix	trans	-66.8	-35.7	176.7	-90.4	176.6	-17.2	0	0	113	Q153 R159 R160 W161	Q153-Q157 PolarHBondContact O-N 2.88Å; Q157-R159 VanDerWaalsContact C-N 3.3Å; Q157-R159 PolarHBondContact O-N 3.26Å; Q157-R160 PolarHBondContact O-N 2.9Å; Q157-R160 VanDerWaalsContact O-N 3.08Å; Q157-W161 VanDerWaalsContact O-CD1 3.29Å
158	A	51.2	Low	56.6	Low	70 Å²	70	123.8 Å²	123.8	58%	0.579	65%	0.646	S	S	*	*	H	α-helix	trans	-64.9	-31.3	178.7	0	0	0	0	0	113.1	Y154 D156 R160	Y154-A158 WeakPolarHBondContact O-CB 3.14Å; Y154-A158 PolarHBondContact O-N 3.41Å; D156-A158 PolarHBondContact O-N 2.94Å; A158-R160 VanDerWaalsContact C-N 3.26Å; A158-R160 PolarHBondContact O-N 3.09Å
159	R	57.3	Low	56.3	Low	229 Å²	229	124.2 Å²	124.2	86%	0.864	65%	0.653	S	S	*	*	H	α-helix	trans	-73.6	-17.7	173.7	-71.3	-143.3	-133.3	-125.2	7.1	113.8	D156 Q157	D156-R159 PolarHBondContact O-N 3.38Å; Q157-R159 VanDerWaalsContact C-N 3.3Å; Q157-R159 PolarHBondContact O-N 3.26Å
160	R	51.1	Low	55.8	Low	186 Å²	186	124.7 Å²	124.7	70%	0.702	66%	0.662	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.3	0.8	-168.4	-136.1	163.6	-175.4	123.5	1.7	114.4	D156 Q157 A158 P162	D156-R160 IonicContact OD2-NH1 3.63Å; Q157-R160 PolarHBondContact O-N 2.9Å; Q157-R160 VanDerWaalsContact O-N 3.08Å; A158-R160 VanDerWaalsContact C-N 3.26Å; A158-R160 PolarHBondContact O-N 3.09Å; R160-P162 VanDerWaalsContact C-CD 3.46Å; R160-P162 VanDerWaalsContact O-CD 3.3Å; R160-P162 WeakPolarHBondContact O-CD 3.47Å
161	W	46.8	Very low	55.3	Low	145 Å²	145	127.1 Å²	127.1	55%	0.549	67%	0.67	S	S	.	*			trans	-113.5	79.8	173.7	-67.8	104	0	0	0	111.5	Q157 L163	Q157-W161 VanDerWaalsContact O-CD1 3.29Å; W161-L163 PolarHBondContact O-N 3.04Å
162	P	62.6	Low	55	Low	92 Å²	92	130.3 Å²	130.3	60%	0.597	69%	0.687	S	S	*	*			trans	-61.4	119.8	162.3	-13.2	27.3	0	0	0	108.4	R160 E164	R160-P162 VanDerWaalsContact C-CD 3.46Å; R160-P162 VanDerWaalsContact O-CD 3.3Å; R160-P162 WeakPolarHBondContact O-CD 3.47Å; P162-E164 PolarHBondContact O-N 3.33Å
163	L	56.8	Low	54.8	Low	171 Å²	171	132.5 Å²	132.5	90%	0.895	69%	0.693	S	S	*	*			trans	-70.7	85.5	160.2	-65.7	172.1	0	0	0	106.3	W161 P165	W161-L163 PolarHBondContact O-N 3.04Å; L163-P165 WeakPolarHBondContact O-CD 3.39Å
164	E	59.1	Low	54.3	Low	149 Å²	149	131.5 Å²	131.5	70%	0.696	70%	0.7	S	S	*	*			trans	-59.2	121.7	172.9	-72.2	-69.3	121.1	0	0	108.7	P162 T166	P162-E164 PolarHBondContact O-N 3.33Å; E164-T166 PolarHBondContact O-N 3.37Å; E164-T166 VanDerWaalsContact O-N 3.14Å
165	P	54	Low	54.7	Low	110 Å²	110	130.8 Å²	130.8	71%	0.714	71%	0.708	S	S	*	*			trans	-68.5	114	174.9	26.8	-29.5	0	0	0	108.3	L163 S167	L163-P165 WeakPolarHBondContact O-CD 3.39Å; P165-S167 PolarHBondContact O-N 2.79Å
166	T	58.7	Low	54.6	Low	130 Å²	130	130.8 Å²	130.8	80%	0.798	72%	0.717	S	S	*	*			trans	-74.2	75.5	175.3	55.9	0	0	0	0	110.1	E164 G168	E164-T166 PolarHBondContact O-N 3.37Å; E164-T166 VanDerWaalsContact O-N 3.14Å; T166-G168 PolarHBondContact O-N 2.87Å
167	S	53.3	Low	54.2	Low	119 Å²	119	134 Å²	134	83%	0.832	73%	0.733	S	S	*	*			trans	-80.2	93.4	165.3	56.7	0	0	0	0	108.7	P165	P165-S167 PolarHBondContact O-N 2.79Å
168	G	50.7	Low	54.5	Low	71 Å²	71	136.3 Å²	136.3	73%	0.732	75%	0.752	S	S	*	*			trans	167.5	23.8	175.7	0	0	0	0	0	118.5	T166	T166-G168 PolarHBondContact O-N 2.87Å
169	L	50.5	Low	54.4	Low	156 Å²	156	138 Å²	138	82%	0.817	76%	0.76	S	S	*	*			trans	-77.5	126	171.5	-87.4	163.6	0	0	0	110.5	Q171	L169-Q171 PolarHBondContact O-N 3.3Å
170	P	50.6	Low	54.4	Low	111 Å²	111	132.4 Å²	132.4	72%	0.721	75%	0.754	S	S	*	*			trans	-70.2	125.8	171.4	27.6	-30.4	0	0	0	109.9	L172	P170-L172 PolarHBondContact O-N 3.28Å
171	Q	50.8	Low	54.4	Low	170 Å²	170	128.2 Å²	128.2	79%	0.794	76%	0.759	S	S	*	*			trans	-58.8	114.2	173.2	-69.4	-84.4	18	0	0	109.9	L169	L169-Q171 PolarHBondContact O-N 3.3Å
172	L	52.7	Low	54.8	Low	170 Å²	170	125.5 Å²	125.5	89%	0.89	77%	0.767	S	S	*	*			trans	-90	95.4	162.4	-72.2	176.6	0	0	0	107.3	P170 S174	P170-L172 PolarHBondContact O-N 3.28Å; L172-S174 PolarHBondContact O-N 3.44Å
173	T	57.7	Low	54.6	Low	111 Å²	111	128.3 Å²	128.3	68%	0.681	78%	0.776	S	S	*	*			trans	-75.1	112.6	168.9	50.3	0	0	0	0	109	N175	T173-N175 PolarHBondContact O-N 2.84Å
174	S	53.9	Low	54.6	Low	103 Å²	103	128.8 Å²	128.8	72%	0.72	77%	0.773	S	S	*	*			trans	-71.5	107.1	165.5	53	0	0	0	0	109	L172	L172-S174 PolarHBondContact O-N 3.44Å
175	N	59.4	Low	54.3	Low	153 Å²	153	130.8 Å²	130.8	82%	0.818	80%	0.804	S	S	*	*			trans	-106.5	114.4	164.5	-76	-6	0	0	0	109.4	T173	T173-N175 PolarHBondContact O-N 2.84Å
176	V	56.5	Low	54.3	Low	128 Å²	128	131.9 Å²	131.9	78%	0.776	81%	0.809	S	S	*	*			trans	-66.3	137.4	-177.3	169.7	0	0	0	0	110.5	T178	V176-T178 PolarHBondContact O-N 2.99Å
177	L	49.4	Very low	54.1	Low	160 Å²	160	131.9 Å²	131.9	84%	0.838	81%	0.809	S	S	*	*			trans	-47.7	119.4	166.3	-178.3	69.3	0	0	0	112.2
178	T	61.5	Low	54.1	Low	128 Å²	128	132.7 Å²	132.7	79%	0.785	81%	0.808	S	S	*	*			trans	-156.5	109.7	153	-64.4	0	0	0	0	108.7	V176	V176-T178 PolarHBondContact O-N 2.99Å
179	S	50	Low	54.4	Low	105 Å²	105	136.3 Å²	136.3	73%	0.734	81%	0.812	S	S	*	*			trans	-86.7	150.3	158.9	-156	0	0	0	0	107
180	P	57	Low	54.6	Low	113 Å²	113	135.1 Å²	135.1	73%	0.734	81%	0.812	S	S	*	*				-156.7	168.8	72.9	37.5	-14.4	0	0	0	118.1
181	A	50.6	Low	54.9	Low	98 Å²	98	136.7 Å²	136.7	81%	0.81	82%	0.818	S	S	*	*			trans	52.3	118.3	139.8	0	0	0	0	0	122.9
182	A	55.1	Low	55.1	Low	88 Å²	88	134.3 Å²	134.3	73%	0.727	82%	0.82	S	S	*	*			trans	-170	109.1	140.9	0	0	0	0	0	107.8
183	L	57.2	Low	55.3	Low	151 Å²	151	131.5 Å²	131.5	79%	0.791	82%	0.815	S	S	*	*				93.9	119.2	89.4	-89.7	164.7	0	0	0	113.9
184	H	57.2	Low	55.1	Low	180 Å²	180	133.3 Å²	133.3	83%	0.833	83%	0.826	S	S	*	*			trans	34.4	115	149.2	-69.3	152.9	0	0	0	120.4
185	S	53.7	Low	55.2	Low	192 Å²	192	136 Å²	136	100%	1.343	84%	0.835	S	S	*	*				-169.1	0	89.4	-175.9	0	0	0	0	110.1

Retrieved 185 of 185 residues in 76.1 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).