A0A5K4F9A0_SCHMA Loading...

DNA repair protein SWI5 homolog

Component of the swi5-sfr1 complex, a complex required for double-strand break repair via homologous recombination.

AlphaFold DB , UniProt , Accession A0A5K4F9A0, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 172 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	55.2	Low	59.6	Low	244 Å²	244	178.7 Å²	178.7	100%	1.202	89%	0.887	S	S	*	*				0	103.4	0	-75.7	-67	167.4	0	0	107.3
2	S	60.5	Low	59	Low	126 Å²	126	178.7 Å²	178.7	88%	0.881	88%	0.882	S	S	*	*	P	Polyproline II helix	trans	-93.3	127.9	-171.7	-59.3	0	0	0	0	110.8
3	T	71.3	Confident	58.9	Low	132 Å²	132	172.2 Å²	172.2	81%	0.81	87%	0.865	S	S	*	*	P	Polyproline II helix	trans	-84.6	138.6	172.3	43.6	0	0	0	0	110.5
4	P	65.3	Low	58.5	Low	129 Å²	129	168.9 Å²	168.9	84%	0.838	87%	0.866	S	S	*	*	P	Polyproline II helix	trans	-82.4	131.6	-176.9	6.4	9.6	0	0	0	111.8
5	T	60.3	Low	58.5	Low	136 Å²	136	166.3 Å²	166.3	83%	0.834	86%	0.861	S	S	*	*	P	Polyproline II helix	trans	-69.4	120.8	174.2	-26.4	0	0	0	0	110.8	K7	T5-K7 PolarHBondContact O-N 3.3Å
6	R	56.6	Low	58.3	Low	243 Å²	243	167.4 Å²	167.4	92%	0.917	86%	0.86	S	S	*	*			trans	-80.3	105.5	176.5	-173.2	175.5	177.6	-174.1	-0.7	110.4
7	K	63.7	Low	58.6	Low	195 Å²	195	161.4 Å²	161.4	85%	0.848	84%	0.841	S	S	*	*			trans	-67.6	143.4	169	-70.1	-174.7	176.6	-179.8	0	111.2	T5	T5-K7 PolarHBondContact O-N 3.3Å
8	T	56.4	Low	59.4	Low	143 Å²	143	158.1 Å²	158.1	88%	0.877	83%	0.831	S	S	*	*			trans	-63.9	134.2	-178.7	47.9	0	0	0	0	112
9	K	59.4	Low	59.5	Low	201 Å²	201	158.9 Å²	158.9	87%	0.874	83%	0.828	S	S	*	*			trans	-118.7	106.1	169.7	-142.6	175.5	-172.2	179.1	0	108	R11	K9-R11 PolarHBondContact O-N 3.1Å
10	K	54.6	Low	59.6	Low	182 Å²	182	161.3 Å²	161.3	79%	0.791	83%	0.831	S	S	*	*			trans	-52.2	116.8	168.9	-72.9	175.8	175.1	177.6	0	108.6
11	R	52.4	Low	59.7	Low	235 Å²	235	158 Å²	158	89%	0.887	82%	0.822	S	S	*	*			trans	-100.9	102.8	162	-77.9	-173.6	171.4	177.8	-2.9	107.2	K9 S13	K9-R11 PolarHBondContact O-N 3.1Å; R11-S13 PolarHBondContact O-N 3.21Å
12	H	51.9	Low	59.7	Low	178 Å²	178	152.8 Å²	152.8	82%	0.824	81%	0.807	S	S	*	*			trans	-76.2	108.5	157.2	-68.3	-84.9	0	0	0	106.4
13	S	58.3	Low	59.6	Low	95 Å²	95	154 Å²	154	66%	0.664	80%	0.803	S	S	*	*			trans	-129.6	117	160.8	56.5	0	0	0	0	107.2	R11 V15	R11-S13 PolarHBondContact O-N 3.21Å; S13-V15 PolarHBondContact O-N 3.32Å
14	S	52.4	Low	59	Low	126 Å²	126	157 Å²	157	88%	0.881	80%	0.804	S	S	*	*			trans	-49	113.8	174.8	50.3	0	0	0	0	111.8
15	V	58.5	Low	58.4	Low	129 Å²	129	162 Å²	162	78%	0.782	81%	0.806	S	S	*	*			trans	-114.4	115.1	159.9	-179.5	0	0	0	0	106.2	S13 A17	S13-V15 PolarHBondContact O-N 3.32Å; V15-A17 VanDerWaalsContact C-N 3.34Å; V15-A17 PolarHBondContact O-N 3.23Å
16	H	56.1	Low	57.9	Low	185 Å²	185	163.4 Å²	163.4	86%	0.856	81%	0.807	S	S	*	*			trans	-72	85.1	179.9	-154.9	-21.8	0	0	0	108.2
17	A	63.8	Low	57.4	Low	65 Å²	65	158.4 Å²	158.4	54%	0.537	80%	0.799	S	S	.	*			trans	-86.2	119.8	167.9	0	0	0	0	0	108.2	V15 F19	V15-A17 VanDerWaalsContact C-N 3.34Å; V15-A17 PolarHBondContact O-N 3.23Å; A17-F19 PolarHBondContact O-N 3.4Å
18	P	72.9	Confident	56.4	Low	101 Å²	101	157.8 Å²	157.8	66%	0.656	80%	0.799	S	S	*	*	S	Bend	trans	-73.9	-3.8	-175.8	21.6	-22.6	0	0	0	114
19	F	61.7	Low	55.8	Low	175 Å²	175	156 Å²	156	77%	0.768	79%	0.792	S	S	*	*			trans	-128.2	109.7	179.8	-39.3	-72.2	0	0	0	109.5	A17 S21	A17-F19 PolarHBondContact O-N 3.4Å; F19-S21 PolarHBondContact O-N 3.15Å
20	K	61.3	Low	55	Low	205 Å²	205	153.4 Å²	153.4	89%	0.891	79%	0.788	S	S	*	*			trans	-81.8	107.5	168.2	-71.6	-173.7	179.9	-178.2	0	107.9
21	S	61.5	Low	54.3	Low	92 Å²	92	149.3 Å²	149.3	64%	0.643	78%	0.782	S	S	*	*			trans	-64.2	129.1	168.6	37.1	0	0	0	0	110	F19 L23	F19-S21 PolarHBondContact O-N 3.15Å; S21-L23 PolarHBondContact O-N 2.92Å
22	P	54.1	Low	53.4	Low	135 Å²	135	148.4 Å²	148.4	88%	0.877	79%	0.785	S	S	*	*			trans	-81.3	62	-179.3	32.4	-33.1	0	0	0	111.1	K24	P22-K24 PolarHBondContact O-N 3.49Å
23	L	58.3	Low	53.1	Low	153 Å²	153	145.7 Å²	145.7	80%	0.801	78%	0.781	S	S	*	*			trans	-90.8	91.6	169.8	-81.6	158.2	0	0	0	109.4	S21 R25	S21-L23 PolarHBondContact O-N 2.92Å; L23-R25 PolarHBondContact O-N 3.12Å
24	K	59.1	Low	52.3	Low	194 Å²	194	148.2 Å²	148.2	84%	0.843	79%	0.787	S	S	*	*			trans	-64.2	121.1	163.9	-82.2	-179.2	176.4	176.3	0	108.5	P22 I26	P22-K24 PolarHBondContact O-N 3.49Å; K24-I26 PolarHBondContact O-N 3.46Å
25	R	52.3	Low	52.2	Low	234 Å²	234	147 Å²	147	88%	0.883	78%	0.776	S	S	*	*			trans	-66.1	110.7	164.4	-73.2	-177.6	-109.5	-173.6	-5.3	108.2	L23 N27	L23-R25 PolarHBondContact O-N 3.12Å; R25-N27 PolarHBondContact O-N 3.35Å
26	I	51.4	Low	51.4	Low	165 Å²	165	145.8 Å²	145.8	85%	0.846	77%	0.769	S	S	*	*			trans	-83.9	97.8	165.9	-61.7	172.8	0	0	0	105.6	K24	K24-I26 PolarHBondContact O-N 3.46Å
27	N	45	Very low	51.2	Low	139 Å²	139	143.1 Å²	143.1	74%	0.743	76%	0.76	S	S	*	*			trans	-69.9	139.8	164.7	-82.1	-5.7	0	0	0	108.7	R25	R25-N27 PolarHBondContact O-N 3.35Å
28	E	42.6	Very low	50.5	Low	182 Å²	182	145.5 Å²	145.5	85%	0.85	76%	0.764	S	S	*	*	S	Bend	trans	-21.6	140.5	166.5	-66.6	165.1	172.5	0	0	116.9
29	S	44.2	Very low	49.4	Very low	106 Å²	106	146.1 Å²	146.1	74%	0.741	76%	0.762	S	S	*	*			trans	104.5	123.9	163.7	75.5	0	0	0	0	116.4
30	N	42.6	Very low	48.9	Very low	145 Å²	145	142.6 Å²	142.6	78%	0.775	75%	0.748	S	S	*	*			trans	97.2	104.2	160.4	-56.1	-21.8	0	0	0	117.9
31	S	39.7	Very low	48.5	Very low	96 Å²	96	135.7 Å²	135.7	67%	0.671	72%	0.723	S	S	*	*			trans	65.3	105.5	135.2	49.8	0	0	0	0	118.3	T33	S31-T33 PolarHBondContact O-N 2.88Å; S31-T33 VanDerWaalsContact O-N 3.1Å
32	F	34.3	Very low	48.3	Very low	216 Å²	216	135.9 Å²	135.9	95%	0.947	72%	0.716	S	S	*	*			trans	-36.9	109.1	149.5	-107.4	-101.9	0	0	0	111.3
33	T	44.2	Very low	48.6	Very low	122 Å²	122	135.5 Å²	135.5	75%	0.748	70%	0.703	S	S	*	*			trans	-136.8	124.9	160.1	53.7	0	0	0	0	108.4	S31	S31-T33 PolarHBondContact O-N 2.88Å; S31-T33 VanDerWaalsContact O-N 3.1Å
34	N	43.2	Very low	48.8	Very low	147 Å²	147	130.4 Å²	130.4	79%	0.786	68%	0.676	S	S	*	*			trans	-41.7	136.1	-176.2	-64.2	-40.8	0	0	0	113.9	T36	N34-T36 PolarHBondContact O-N 2.73Å
35	P	48.8	Very low	49.1	Very low	100 Å²	100	125.4 Å²	125.4	65%	0.649	66%	0.658	S	S	*	*			trans	-70.1	129.5	171.3	30	-30.1	0	0	0	109.2	I37	P35-I37 PolarHBondContact O-N 3.47Å; P35-I37 VanDerWaalsContact O-N 3.16Å
36	T	42	Very low	49.8	Very low	104 Å²	104	120.8 Å²	120.8	64%	0.638	65%	0.647	S	S	*	*			trans	-60.5	111.2	177	-45.2	0	0	0	0	110	N34 N38 N39	N34-T36 PolarHBondContact O-N 2.73Å; T36-N38 PolarHBondContact O-N 3.38Å; T36-N39 PolarHBondContact O-N 3.45Å
37	I	51.9	Low	50.4	Low	130 Å²	130	117.5 Å²	117.5	67%	0.667	63%	0.628	S	S	*	*	H	α-helix	trans	-57.6	-22.2	-174.6	-64.8	168.4	0	0	0	113.2	P35 N39	P35-I37 PolarHBondContact O-N 3.47Å; P35-I37 VanDerWaalsContact O-N 3.16Å; I37-N39 PolarHBondContact O-N 2.96Å
38	N	49.4	Very low	51.4	Low	115 Å²	115	113.8 Å²	113.8	62%	0.615	61%	0.608	S	S	*	*	H	α-helix	trans	-79.4	-13.5	-173.2	-78.6	0.3	0	0	0	116.1	T36 T41	T36-N38 PolarHBondContact O-N 3.38Å; N38-T41 PolarHBondContact O-OG1 3.48Å
39	N	50.3	Low	52.6	Low	114 Å²	114	109.9 Å²	109.9	61%	0.61	59%	0.593	S	S	*	*	H	α-helix	trans	-91	-26.1	179.2	-74.5	-6.3	0	0	0	112.8	T36 I37	T36-N39 PolarHBondContact O-N 3.45Å; I37-N39 PolarHBondContact O-N 2.96Å
40	Q	51.2	Low	53.7	Low	101 Å²	101	108.4 Å²	108.4	47%	0.472	58%	0.579	S	S	.	*	H	α-helix	trans	-73.2	-30.7	177.3	-71	178.6	-14.8	0	0	112.2	N42 E43 I44	Q40-N42 VanDerWaalsContact C-N 3.28Å; Q40-N42 PolarHBondContact O-N 3.15Å; Q40-E43 PolarHBondContact O-N 3.12Å; Q40-I44 WeakPolarHBondContact O-CD1 3.36Å; Q40-I44 VanDerWaalsContact O-CG1 3.23Å; Q40-I44 WeakPolarHBondContact O-CG1 3.33Å; Q40-I44 PolarHBondContact O-N 3.4Å; Q40-I44 VanDerWaalsContact O-N 3.12Å
41	T	52.7	Low	54.6	Low	60 Å²	60	103.9 Å²	103.9	37%	0.368	55%	0.554	S	S	.	*	H	α-helix	trans	-64.8	-31.5	177.8	48.8	0	0	0	0	112.7	N38 N45	N38-T41 PolarHBondContact O-OG1 3.48Å; T41-N45 WeakPolarHBondContact O-CB 3.47Å; T41-N45 PolarHBondContact O-N 3.03Å; T41-N45 VanDerWaalsContact O-N 3.11Å; T41-N45 PolarHBondContact O-ND2 2.72Å
42	N	57.7	Low	55.7	Low	95 Å²	95	105.6 Å²	105.6	51%	0.508	55%	0.55	S	S	.	.	H	α-helix	trans	-74.9	-41.7	179.8	-67.9	-11.2	0	0	0	111.8	Q40 N45 E46	Q40-N42 VanDerWaalsContact C-N 3.28Å; Q40-N42 PolarHBondContact O-N 3.15Å; N42-N45 PolarHBondContact O-N 3.36Å; N42-E46 PolarHBondContact O-N 3.37Å
43	E	59.3	Low	57	Low	127 Å²	127	99.8 Å²	99.8	59%	0.593	54%	0.536	S	S	*	.	H	α-helix	trans	-65.9	-37.5	175.9	-71.8	179.7	174.3	0	0	112.1	Q40 E46 Q47	Q40-E43 PolarHBondContact O-N 3.12Å; E43-E46 PolarHBondContact O-N 3.46Å; E43-Q47 WeakPolarHBondContact O-CG 3.38Å; E43-Q47 PolarHBondContact O-N 3.06Å
44	I	62	Low	57.6	Low	46 Å²	46	100.4 Å²	100.4	24%	0.236	53%	0.53	C	S	.	.	H	α-helix	trans	-66.2	-40.5	175.9	-69.6	165.2	0	0	0	111.2	Q40 Q47 L48 L150	Q40-I44 WeakPolarHBondContact O-CD1 3.36Å; Q40-I44 VanDerWaalsContact O-CG1 3.23Å; Q40-I44 WeakPolarHBondContact O-CG1 3.33Å; Q40-I44 PolarHBondContact O-N 3.4Å; Q40-I44 VanDerWaalsContact O-N 3.12Å; I44-Q47 PolarHBondContact O-N 2.82Å; I44-L48 HydrophobicContact CG2-CD1 4.11Å; I44-L48 WeakPolarHBondContact O-CB 3.46Å; I44-L48 PolarHBondContact O-N 3.16Å; I44-L150 HydrophobicContact CD1-CD2 3.94Å; I44-L150 HydrophobicContact CG1-CD2 4.47Å; I44-L150 HydrophobicContact CG2-CD2 3.74Å
45	N	65.7	Low	58	Low	89 Å²	89	97.5 Å²	97.5	48%	0.476	51%	0.514	S	S	.	.	H	α-helix	trans	-67.5	-39.4	178.1	-74	-25.9	0	0	0	111.7	T41 N42 L48 D49	T41-N45 WeakPolarHBondContact O-CB 3.47Å; T41-N45 PolarHBondContact O-N 3.03Å; T41-N45 VanDerWaalsContact O-N 3.11Å; T41-N45 PolarHBondContact O-ND2 2.72Å; N42-N45 PolarHBondContact O-N 3.36Å; N45-L48 PolarHBondContact O-N 3.31Å; N45-D49 PolarHBondContact O-N 2.98Å
46	E	66.7	Low	58.1	Low	137 Å²	137	97.9 Å²	97.9	64%	0.64	51%	0.511	S	S	*	.	H	α-helix	trans	-63.2	-41.8	173.3	-75.2	-177.4	178.6	0	0	111.8	N42 E43 D49 V50	N42-E46 PolarHBondContact O-N 3.37Å; E43-E46 PolarHBondContact O-N 3.46Å; E46-D49 PolarHBondContact O-N 3.37Å; E46-V50 VanDerWaalsContact O-CG2 3.29Å; E46-V50 WeakPolarHBondContact O-CG2 3.47Å; E46-V50 PolarHBondContact O-N 3.48Å
47	Q	65.9	Low	58.6	Low	96 Å²	96	99.3 Å²	99.3	45%	0.449	51%	0.514	S	S	.	.	H	α-helix	trans	-64.3	-40	175.2	-72	175.2	23.9	0	0	112.2	E43 I44 V50 I51	E43-Q47 WeakPolarHBondContact O-CG 3.38Å; E43-Q47 PolarHBondContact O-N 3.06Å; I44-Q47 PolarHBondContact O-N 2.82Å; Q47-V50 PolarHBondContact O-N 3.06Å; Q47-I51 VanDerWaalsContact O-CG1 3.28Å; Q47-I51 WeakPolarHBondContact O-CG1 3.3Å; Q47-I51 PolarHBondContact O-N 3.4Å
48	L	65.5	Low	58.6	Low	61 Å²	61	99.2 Å²	99.2	32%	0.319	52%	0.515	S	S	.	.	H	α-helix	trans	-64.8	-39.1	176	-86.1	166.1	0	0	0	112.6	I44 N45 I51 K52	I44-L48 HydrophobicContact CG2-CD1 4.11Å; I44-L48 WeakPolarHBondContact O-CB 3.46Å; I44-L48 PolarHBondContact O-N 3.16Å; N45-L48 PolarHBondContact O-N 3.31Å; L48-I51 PolarHBondContact O-N 3.49Å; L48-K52 WeakPolarHBondContact O-CB 3.49Å; L48-K52 VanDerWaalsContact O-CG 3.25Å; L48-K52 WeakPolarHBondContact O-CG 3.13Å; L48-K52 PolarHBondContact O-N 3.44Å
49	D	67.5	Low	58.8	Low	101 Å²	101	97.7 Å²	97.7	54%	0.54	51%	0.507	S	S	.	.	H	α-helix	trans	-70	-34.9	176.8	-83.5	-5.8	0	0	0	111.8	N45 E46 K52 S53	N45-D49 PolarHBondContact O-N 2.98Å; E46-D49 PolarHBondContact O-N 3.37Å; D49-K52 PolarHBondContact O-N 3Å; D49-K52 IonicContact OD1-NZ 2.67Å; D49-S53 WeakPolarHBondContact O-CB 3.35Å; D49-S53 PolarHBondContact O-N 3.19Å; D49-S53 PolarHBondContact O-OG 3.33Å
50	V	67.7	Low	58.9	Low	74 Å²	74	95.5 Å²	95.5	45%	0.448	49%	0.494	S	S	.	.	H	α-helix	trans	-62.9	-47.8	171.4	172.9	0	0	0	0	110.7	E46 Q47 K52 S53 Q54	E46-V50 VanDerWaalsContact O-CG2 3.29Å; E46-V50 WeakPolarHBondContact O-CG2 3.47Å; E46-V50 PolarHBondContact O-N 3.48Å; Q47-V50 PolarHBondContact O-N 3.06Å; V50-K52 PolarHBondContact O-N 3.39Å; V50-S53 PolarHBondContact O-N 3.21Å; V50-S53 PolarHBondContact O-OG 3.39Å; V50-Q54 WeakPolarHBondContact O-CG 3.49Å; V50-Q54 PolarHBondContact O-N 3.32Å; V50-Q54 VanDerWaalsContact O-N 3.14Å
51	I	61.9	Low	58.7	Low	50 Å²	50	95.8 Å²	95.8	26%	0.256	50%	0.499	S	S	.	.	H	α-helix	trans	-62.7	-43.5	178.3	-67.4	164.5	0	0	0	110.9	Q47 L48 S53 Q54 L55 I146	Q47-I51 VanDerWaalsContact O-CG1 3.28Å; Q47-I51 WeakPolarHBondContact O-CG1 3.3Å; Q47-I51 PolarHBondContact O-N 3.4Å; L48-I51 PolarHBondContact O-N 3.49Å; I51-S53 VanDerWaalsContact C-N 3.32Å; I51-S53 PolarHBondContact O-N 3.4Å; I51-Q54 PolarHBondContact O-N 2.94Å; I51-L55 HydrophobicContact CG2-CD1 3.88Å; I51-L55 HydrophobicContact CG2-CG 4.42Å; I51-L55 WeakPolarHBondContact O-CG 3.47Å; I51-L55 PolarHBondContact O-N 2.89Å; I51-I146 HydrophobicContact CD1-CD1 3.88Å
52	K	62	Low	58.8	Low	133 Å²	133	99.6 Å²	99.6	58%	0.578	51%	0.513	S	S	*	.	H	α-helix	trans	-62.5	-37.4	175.9	-75.6	172.3	-172.6	168.9	0	112.8	L48 D49 V50 Q54	L48-K52 WeakPolarHBondContact O-CB 3.49Å; L48-K52 VanDerWaalsContact O-CG 3.25Å; L48-K52 WeakPolarHBondContact O-CG 3.13Å; L48-K52 PolarHBondContact O-N 3.44Å; D49-K52 PolarHBondContact O-N 3Å; D49-K52 IonicContact OD1-NZ 2.67Å; V50-K52 PolarHBondContact O-N 3.39Å; K52-Q54 VanDerWaalsContact C-N 3.26Å; K52-Q54 PolarHBondContact O-N 2.76Å
53	S	61.7	Low	58.4	Low	93 Å²	93	101 Å²	101	65%	0.65	52%	0.516	S	S	*	.	H	α-helix	trans	-70	-23.7	177.9	73.4	0	0	0	0	113.2	D49 V50 I51	D49-S53 WeakPolarHBondContact O-CB 3.35Å; D49-S53 PolarHBondContact O-N 3.19Å; D49-S53 PolarHBondContact O-OG 3.33Å; V50-S53 PolarHBondContact O-N 3.21Å; V50-S53 PolarHBondContact O-OG 3.39Å; I51-S53 VanDerWaalsContact C-N 3.32Å; I51-S53 PolarHBondContact O-N 3.4Å
54	Q	56.2	Low	58.2	Low	136 Å²	136	98 Å²	98	64%	0.636	51%	0.506	S	S	*	.	H	α-helix	trans	-90.1	-24.2	178.5	-68.6	175	16.2	0	0	112.7	V50 I51 K52 N56	V50-Q54 WeakPolarHBondContact O-CG 3.49Å; V50-Q54 PolarHBondContact O-N 3.32Å; V50-Q54 VanDerWaalsContact O-N 3.14Å; I51-Q54 PolarHBondContact O-N 2.94Å; K52-Q54 VanDerWaalsContact C-N 3.26Å; K52-Q54 PolarHBondContact O-N 2.76Å; Q54-N56 VanDerWaalsContact C-N 3.26Å; Q54-N56 PolarHBondContact O-N 2.92Å
55	L	51.6	Low	57.6	Low	86 Å²	86	101 Å²	101	45%	0.45	52%	0.523	S	S	.	.			trans	-76.7	74.2	173.4	-71.1	169.4	0	0	0	111.2	I51 L57 I60	I51-L55 HydrophobicContact CG2-CD1 3.88Å; I51-L55 HydrophobicContact CG2-CG 4.42Å; I51-L55 WeakPolarHBondContact O-CG 3.47Å; I51-L55 PolarHBondContact O-N 2.89Å; L55-L57 PolarHBondContact O-N 3.25Å; L55-I60 HydrophobicContact CD2-CD1 3.96Å
56	N	51.5	Low	56.9	Low	107 Å²	107	102.6 Å²	102.6	57%	0.572	53%	0.531	S	S	*	.			trans	-70.3	95.9	165.4	-137.2	-10.6	0	0	0	107.8	Q54 N58 D59	Q54-N56 VanDerWaalsContact C-N 3.26Å; Q54-N56 PolarHBondContact O-N 2.92Å; N56-N58 PolarHBondContact O-N 3.45Å; N56-D59 PolarHBondContact O-N 3.46Å
57	L	53.1	Low	55.9	Low	134 Å²	134	100.9 Å²	100.9	70%	0.702	52%	0.521	S	S	*	.	H	α-helix	trans	-52.4	-16.1	-173	-79.8	156.2	0	0	0	115.1	L55	L55-L57 PolarHBondContact O-N 3.25Å
58	N	51	Low	55.1	Low	129 Å²	129	102.4 Å²	102.4	69%	0.69	53%	0.528	S	S	*	.	H	α-helix	trans	-84.1	-16.6	179.9	-65	-29.3	0	0	0	114.6	N56	N56-N58 PolarHBondContact O-N 3.45Å
59	D	53.1	Low	54.7	Low	83 Å²	83	103.3 Å²	103.3	44%	0.444	54%	0.536	S	S	.	.	H	α-helix	trans	-89.2	-22.5	178.9	-81.1	-31.9	0	0	0	113	N56 D61 Q62 Q63	N56-D59 PolarHBondContact O-N 3.46Å; D59-D61 PolarHBondContact O-N 3.37Å; D59-Q62 PolarHBondContact O-N 3.12Å; D59-Q63 WeakPolarHBondContact O-CG 3.23Å; D59-Q63 PolarHBondContact O-N 3.03Å; D59-Q63 VanDerWaalsContact O-N 3.15Å
60	I	52.2	Low	53.9	Low	67 Å²	67	101.5 Å²	101.5	34%	0.344	53%	0.525	S	S	.	.	H	α-helix	trans	-67.8	-37.7	-176.7	-58.9	173.2	0	0	0	111	L55 Q62 Q63 T64	L55-I60 HydrophobicContact CD2-CD1 3.96Å; I60-Q62 VanDerWaalsContact C-N 3.28Å; I60-Q62 PolarHBondContact O-N 2.76Å; I60-Q63 PolarHBondContact O-N 3.29Å; I60-T64 HydrophobicContact CG2-CG2 3.98Å; I60-T64 WeakPolarHBondContact O-CB 3.36Å; I60-T64 WeakPolarHBondContact O-CG2 3.35Å; I60-T64 PolarHBondContact O-N 3.18Å; I60-T64 PolarHBondContact O-OG1 2.87Å
61	D	48.2	Very low	53.2	Low	107 Å²	107	103.9 Å²	103.9	57%	0.572	53%	0.534	S	S	*	.	H	α-helix	trans	-67.1	-29.2	178.3	-75.2	-18.1	0	0	0	112.5	D59 T64 N65	D59-D61 PolarHBondContact O-N 3.37Å; D61-T64 WeakPolarHBondContact CA-OG1 3.29Å; D61-T64 PolarHBondContact O-OG1 3.44Å; D61-N65 WeakPolarHBondContact O-CB 3.14Å; D61-N65 PolarHBondContact O-N 2.59Å; D61-N65 PolarHBondContact O-ND2 2.97Å
62	Q	53.5	Low	52.6	Low	141 Å²	141	111.1 Å²	111.1	66%	0.659	56%	0.558	S	S	*	*	H	α-helix	trans	-78.2	-39.2	175.9	-63.8	-171.7	34.6	0	0	111.5	D59 I60 L66	D59-Q62 PolarHBondContact O-N 3.12Å; I60-Q62 VanDerWaalsContact C-N 3.28Å; I60-Q62 PolarHBondContact O-N 2.76Å; Q62-L66 PolarHBondContact O-N 3.25Å
63	Q	51.1	Low	52.1	Low	123 Å²	123	111.8 Å²	111.8	58%	0.575	56%	0.563	S	S	*	*	H	α-helix	trans	-71.1	-39.4	178.8	-68.1	-174.8	24.5	0	0	112.6	D59 I60 L66 F67	D59-Q63 WeakPolarHBondContact O-CG 3.23Å; D59-Q63 PolarHBondContact O-N 3.03Å; D59-Q63 VanDerWaalsContact O-N 3.15Å; I60-Q63 PolarHBondContact O-N 3.29Å; Q63-L66 PolarHBondContact O-N 2.9Å; Q63-F67 PolarHBondContact O-N 3.44Å
64	T	54.6	Low	51.5	Low	64 Å²	64	112.7 Å²	112.7	39%	0.393	56%	0.56	S	S	.	*	H	α-helix	trans	-66.3	-38.5	178.1	51.7	0	0	0	0	112.3	I60 D61 F67 H68	I60-T64 HydrophobicContact CG2-CG2 3.98Å; I60-T64 WeakPolarHBondContact O-CB 3.36Å; I60-T64 WeakPolarHBondContact O-CG2 3.35Å; I60-T64 PolarHBondContact O-N 3.18Å; I60-T64 PolarHBondContact O-OG1 2.87Å; D61-T64 WeakPolarHBondContact CA-OG1 3.29Å; D61-T64 PolarHBondContact O-OG1 3.44Å; T64-F67 PolarHBondContact O-N 2.83Å; T64-H68 PolarHBondContact O-N 3.42Å
65	N	48.4	Very low	50.9	Low	110 Å²	110	109.3 Å²	109.3	59%	0.588	56%	0.562	S	S	*	*	H	α-helix	trans	-66.8	-35.4	174	-79.6	-46.8	0	0	0	112.7	D61 T69	D61-N65 WeakPolarHBondContact O-CB 3.14Å; D61-N65 PolarHBondContact O-N 2.59Å; D61-N65 PolarHBondContact O-ND2 2.97Å; N65-T69 PolarHBondContact O-N 3.08Å; N65-T69 PolarHBondContact O-OG1 3.33Å
66	L	51.9	Low	50.8	Low	122 Å²	122	111.5 Å²	111.5	64%	0.639	57%	0.574	S	S	*	*	H	α-helix	trans	-68.9	-39.8	175.4	-161.7	77	0	0	0	112.1	Q62 Q63 T69 E70	Q62-L66 PolarHBondContact O-N 3.25Å; Q63-L66 PolarHBondContact O-N 2.9Å; L66-T69 WeakPolarHBondContact CA-OG1 3.46Å; L66-T69 PolarHBondContact O-N 3.26Å; L66-T69 PolarHBondContact O-OG1 3Å; L66-E70 PolarHBondContact O-N 3.46Å; L66-E70 VanDerWaalsContact O-N 3.17Å
67	F	45.4	Very low	50.5	Low	101 Å²	101	114.5 Å²	114.5	44%	0.443	59%	0.585	S	S	.	*	H	α-helix	trans	-65.9	-39.3	174.7	-98.9	-82.8	0	0	0	112.9	Q63 T64 T69 E70 L71	Q63-F67 PolarHBondContact O-N 3.44Å; T64-F67 PolarHBondContact O-N 2.83Å; F67-T69 VanDerWaalsContact C-N 3.31Å; F67-T69 PolarHBondContact O-N 3Å; F67-E70 PolarHBondContact O-N 3.47Å; F67-L71 PolarHBondContact O-N 3.03Å; F67-L71 VanDerWaalsContact O-N 3.13Å
68	H	50.2	Low	50	Low	129 Å²	129	115.8 Å²	115.8	60%	0.597	59%	0.593	S	S	*	*	H	α-helix	trans	-67.5	-31.1	178.8	-109.1	-53	0	0	0	113.4	T64	T64-H68 PolarHBondContact O-N 3.42Å
69	T	56	Low	49.9	Very low	79 Å²	79	117.2 Å²	117.2	49%	0.485	60%	0.598	S	S	.	*	H	α-helix	trans	-76.8	-37.3	177	36.8	0	0	0	0	111.9	N65 L66 F67 R72 H73	N65-T69 PolarHBondContact O-N 3.08Å; N65-T69 PolarHBondContact O-OG1 3.33Å; L66-T69 WeakPolarHBondContact CA-OG1 3.46Å; L66-T69 PolarHBondContact O-N 3.26Å; L66-T69 PolarHBondContact O-OG1 3Å; F67-T69 VanDerWaalsContact C-N 3.31Å; F67-T69 PolarHBondContact O-N 3Å; T69-R72 PolarHBondContact O-N 2.89Å; T69-H73 PolarHBondContact O-CD2 3.39Å
70	E	50.5	Low	49.6	Very low	63 Å²	63	121.5 Å²	121.5	29%	0.294	62%	0.615	S	S	.	*	H	α-helix	trans	-66.2	-40.6	174.3	-104.7	-166.1	178.1	0	0	113.5	L66 F67 R72 H73 L74 K129 R133	L66-E70 PolarHBondContact O-N 3.46Å; L66-E70 VanDerWaalsContact O-N 3.17Å; F67-E70 PolarHBondContact O-N 3.47Å; E70-R72 VanDerWaalsContact C-N 3.26Å; E70-R72 PolarHBondContact O-N 3.03Å; E70-H73 PolarHBondContact O-N 3.48Å; E70-H73 VanDerWaalsContact O-N 3.12Å; E70-L74 WeakPolarHBondContact O-CD1 3.42Å; E70-L74 PolarHBondContact O-N 3.34Å; E70-K129 WeakPolarHBondContact OE1-CE 3.36Å; E70-K129 IonicContact OE1-NZ 3.58Å; E70-K129 PolarHBondContact OE1-NZ 3.41Å; E70-K129 WeakPolarHBondContact OE2-CE 3.45Å; E70-K129 IonicContact OE2-NZ 3.63Å; E70-K129 PolarHBondContact OE2-NZ 3.37Å; E70-R133 IonicContact OE2-CZ 3.99Å; E70-R133 IonicContact OE2-NH2 2.72Å; E70-R133 PolarHBondContact OE2-NH2 3.4Å
71	L	53.4	Low	49.3	Very low	124 Å²	124	123.5 Å²	123.5	65%	0.649	63%	0.633	S	S	*	*	H	α-helix	trans	-65	-28.3	179.2	-83.1	163.4	0	0	0	113	F67 H73	F67-L71 PolarHBondContact O-N 3.03Å; F67-L71 VanDerWaalsContact O-N 3.13Å; L71-H73 VanDerWaalsContact C-N 3.33Å
72	R	49.1	Very low	49	Very low	202 Å²	202	122.8 Å²	122.8	76%	0.762	64%	0.642	S	S	*	*	H	α-helix	trans	-72.9	-23.7	174.5	-76.3	-172	-177.3	-161.8	2.4	113.4	T69 E70	T69-R72 PolarHBondContact O-N 2.89Å; E70-R72 VanDerWaalsContact C-N 3.26Å; E70-R72 PolarHBondContact O-N 3.03Å
73	H	50.7	Low	48.4	Very low	147 Å²	147	125.5 Å²	125.5	68%	0.681	65%	0.651	S	S	*	*	H	α-helix	trans	-83.8	-27.6	-179.9	-81.8	-61.2	0	0	0	113.5	T69 E70 L71 G75	T69-H73 PolarHBondContact O-CD2 3.39Å; E70-H73 PolarHBondContact O-N 3.48Å; E70-H73 VanDerWaalsContact O-N 3.12Å; L71-H73 VanDerWaalsContact C-N 3.33Å; H73-G75 PolarHBondContact O-N 3.06Å
74	L	50	Low	48	Very low	112 Å²	112	125.3 Å²	125.3	59%	0.586	66%	0.658	S	S	*	*	H	α-helix	trans	-77.6	-14.1	178.9	-87.8	92.3	0	0	0	114.8	E70 N76	E70-L74 WeakPolarHBondContact O-CD1 3.42Å; E70-L74 PolarHBondContact O-N 3.34Å; L74-N76 VanDerWaalsContact C-N 3.28Å; L74-N76 PolarHBondContact O-N 3.11Å
75	G	44	Very low	47.4	Very low	66 Å²	66	127.1 Å²	127.1	68%	0.68	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76	-7.8	-179.8	0	0	0	0	0	115.7	H73	H73-G75 PolarHBondContact O-N 3.06Å
76	N	48.5	Very low	47.2	Very low	132 Å²	132	129 Å²	129	71%	0.706	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	-116.8	-0.6	-167.6	-67.1	-12.3	0	0	0	114.8	L74 N78	L74-N76 VanDerWaalsContact C-N 3.28Å; L74-N76 PolarHBondContact O-N 3.11Å; N76-N78 PolarHBondContact O-N 2.93Å
77	E	46.5	Very low	46.8	Very low	169 Å²	169	130 Å²	130	79%	0.79	69%	0.688	S	S	*	*			trans	-87.4	90.7	178.4	-64.7	-159.1	165	0	0	111.2	I79	E77-I79 PolarHBondContact O-N 3.23Å
78	N	41.3	Very low	46.8	Very low	162 Å²	162	132.7 Å²	132.7	87%	0.866	71%	0.707	S	S	*	*			trans	-60.9	97.3	166.8	-87	-54.9	0	0	0	110.6	N76 H80	N76-N78 PolarHBondContact O-N 2.93Å; N78-H80 PolarHBondContact O-N 2.84Å; N78-H80 VanDerWaalsContact O-N 3.11Å
79	I	49.1	Very low	46.7	Very low	158 Å²	158	132.5 Å²	132.5	81%	0.81	72%	0.715	S	S	*	*			trans	-75.4	95.7	169.1	-58.1	172.1	0	0	0	108	E77 P81	E77-I79 PolarHBondContact O-N 3.23Å; I79-P81 WeakPolarHBondContact O-CD 3.46Å
80	H	46.4	Very low	46.1	Very low	174 Å²	174	135.6 Å²	135.6	81%	0.806	73%	0.728	S	S	*	*			trans	-83.8	112.1	170.4	-154.4	-65.3	0	0	0	108.5	N78 A82	N78-H80 PolarHBondContact O-N 2.84Å; N78-H80 VanDerWaalsContact O-N 3.11Å; H80-A82 PolarHBondContact O-N 3.46Å; H80-A82 VanDerWaalsContact O-N 3.13Å
81	P	47.5	Very low	46	Very low	109 Å²	109	138.7 Å²	138.7	71%	0.708	75%	0.747	S	S	*	*			trans	-69.7	113.9	176.4	27.1	-31.7	0	0	0	109.1	I79 K83	I79-P81 WeakPolarHBondContact O-CD 3.46Å; P81-K83 PolarHBondContact O-N 2.86Å; P81-K83 VanDerWaalsContact O-N 3.15Å
82	A	41.4	Very low	45.9	Very low	92 Å²	92	139.9 Å²	139.9	76%	0.76	75%	0.754	S	S	*	*			trans	-71.1	107	173.5	0	0	0	0	0	109.6	H80 V84	H80-A82 PolarHBondContact O-N 3.46Å; H80-A82 VanDerWaalsContact O-N 3.13Å; A82-V84 PolarHBondContact O-N 3.39Å
83	K	40.8	Very low	45.9	Very low	197 Å²	197	138.5 Å²	138.5	86%	0.857	76%	0.756	S	S	*	*			trans	-68.9	108.4	171.6	-165.6	177.4	-174.7	-178.4	0	108.6	P81 S85	P81-K83 PolarHBondContact O-N 2.86Å; P81-K83 VanDerWaalsContact O-N 3.15Å; K83-S85 PolarHBondContact O-N 3.45Å
84	V	41.8	Very low	46	Very low	120 Å²	120	138.1 Å²	138.1	73%	0.727	76%	0.759	S	S	*	*			trans	-85.9	104.5	175.2	-179.2	0	0	0	0	108.4	A82 I86	A82-V84 PolarHBondContact O-N 3.39Å; V84-I86 HydrophobicContact CG1-CG1 3.99Å
85	S	43	Very low	46.2	Very low	102 Å²	102	141.2 Å²	141.2	71%	0.713	77%	0.768	S	S	*	*			trans	-80	121.3	163.3	-65	0	0	0	0	108.7	K83	K83-S85 PolarHBondContact O-N 3.45Å
86	I	45	Very low	46.6	Very low	149 Å²	149	144.3 Å²	144.3	76%	0.764	77%	0.769	S	S	*	*			trans	-102.4	95.8	175.1	-57.3	171.5	0	0	0	106.1	V84	V84-I86 HydrophobicContact CG1-CG1 3.99Å
87	D	41.7	Very low	47	Very low	142 Å²	142	147.8 Å²	147.8	76%	0.759	78%	0.781	S	S	*	*			trans	-147.9	103.5	169.1	-78.6	-42.8	0	0	0	108.7
88	N	45.8	Very low	47.5	Very low	158 Å²	158	146.7 Å²	146.7	85%	0.845	78%	0.779	S	S	*	*			trans	167.4	93.2	131.8	-87	-18.9	0	0	0	109.5	N90	N88-N90 PolarHBondContact O-N 3.26Å
89	V	47.5	Very low	48.5	Very low	126 Å²	126	143.4 Å²	143.4	76%	0.764	76%	0.762	S	S	*	*			trans	-58.1	121.2	151.5	178.3	0	0	0	0	106.6
90	N	45.3	Very low	49.1	Very low	143 Å²	143	141.9 Å²	141.9	77%	0.765	76%	0.755	S	S	*	*			trans	-136.8	104.3	160.7	-150.6	22.7	0	0	0	108.2	N88 N92	N88-N90 PolarHBondContact O-N 3.26Å; N90-N92 PolarHBondContact O-N 2.9Å
91	D	47.6	Very low	50.1	Low	129 Å²	129	139 Å²	139	69%	0.69	75%	0.746	S	S	*	*			trans	-58.2	122.9	171.9	-56.6	-52.2	0	0	0	109.3
92	N	50.7	Low	51.1	Low	148 Å²	148	136 Å²	136	79%	0.791	73%	0.728	S	S	*	*			trans	-141.3	106.1	150.9	-76.4	-66.5	0	0	0	107.2	N90	N90-N92 PolarHBondContact O-N 2.9Å
93	E	49.3	Very low	52.6	Low	173 Å²	173	138.3 Å²	138.3	81%	0.808	72%	0.723	S	S	*	*			trans	-58.8	165.6	165.6	-63	175.9	144	0	0	110.7
94	D	53.9	Low	54.2	Low	139 Å²	139	133.4 Å²	133.4	74%	0.743	71%	0.705	S	S	*	*			trans	89.9	100	165.3	-53.3	-27.5	0	0	0	116.5
95	K	52.9	Low	55.9	Low	178 Å²	178	133.7 Å²	133.7	77%	0.774	70%	0.698	S	S	*	*				129.4	132.1	121.8	-62.1	-154.9	-179.2	171.1	0	114.9
96	D	53.6	Low	57.5	Low	131 Å²	131	134 Å²	134	70%	0.701	69%	0.692	S	S	*	*			trans	87.5	97.9	152	-56.6	-20.9	0	0	0	116.8	L98	D96-L98 PolarHBondContact O-N 3.47Å
97	E	56	Low	58.9	Low	204 Å²	204	130.3 Å²	130.3	95%	0.953	68%	0.679	S	S	*	*			trans	-58.6	55.7	167.7	-161.7	174.2	-153.1	0	0	112.1
98	L	56.9	Low	60.6	Low	146 Å²	146	127.6 Å²	127.6	76%	0.764	66%	0.663	S	S	*	*			trans	-134.8	108.5	-177.7	-73.7	169.4	0	0	0	110.4	D96	D96-L98 PolarHBondContact O-N 3.47Å
99	D	62.3	Low	61.9	Low	93 Å²	93	124.3 Å²	124.3	50%	0.497	65%	0.646	S	S	.	*			trans	92.6	60.4	147.3	-135.4	19.3	0	0	0	117.1	D101 S102 E103	D99-D101 PolarHBondContact O-N 3.43Å; D99-D101 VanDerWaalsContact O-N 3.09Å; D99-S102 VanDerWaalsContact CG-OG 3.27Å; D99-S102 WeakPolarHBondContact O-CA 3.38Å; D99-S102 WeakPolarHBondContact O-CB 3.36Å; D99-S102 PolarHBondContact O-N 3.33Å; D99-S102 WeakPolarHBondContact OD2-CB 3.3Å; D99-S102 PolarHBondContact OD2-OG 3.3Å; D99-E103 PolarHBondContact O-N 3.05Å; D99-E103 VanDerWaalsContact O-N 3.12Å
100	D	61.3	Low	63.3	Low	126 Å²	126	124.5 Å²	124.5	67%	0.674	64%	0.636	S	S	*	*	H	α-helix	trans	-46.8	-35.2	167	-75.5	-15.6	0	0	0	112	E103 I104	D100-E103 PolarHBondContact O-N 3.03Å; D100-I104 WeakPolarHBondContact O-CB 3.32Å; D100-I104 WeakPolarHBondContact O-CD1 3.44Å; D100-I104 WeakPolarHBondContact O-CG1 3.4Å; D100-I104 PolarHBondContact O-N 3.48Å
101	D	68.2	Low	64.4	Low	115 Å²	115	123.3 Å²	123.3	62%	0.615	63%	0.629	S	S	*	*	H	α-helix	trans	-66.2	-37.3	177.5	-70.8	-24.3	0	0	0	111.9	D99 I104 E105	D99-D101 PolarHBondContact O-N 3.43Å; D99-D101 VanDerWaalsContact O-N 3.09Å; D101-I104 PolarHBondContact O-N 3.32Å; D101-E105 WeakPolarHBondContact O-CB 3.37Å; D101-E105 WeakPolarHBondContact O-CG 3.47Å; D101-E105 PolarHBondContact O-N 3.15Å
102	S	67.4	Low	65.3	Low	45 Å²	45	121.8 Å²	121.8	32%	0.315	62%	0.62	S	S	.	*	H	α-helix	trans	-70	-34.9	173.8	-80.4	0	0	0	0	112.6	D99 N106	D99-S102 VanDerWaalsContact CG-OG 3.27Å; D99-S102 WeakPolarHBondContact O-CA 3.38Å; D99-S102 WeakPolarHBondContact O-CB 3.36Å; D99-S102 PolarHBondContact O-N 3.33Å; D99-S102 WeakPolarHBondContact OD2-CB 3.3Å; D99-S102 PolarHBondContact OD2-OG 3.3Å; S102-N106 VanDerWaalsContact O-CB 3.29Å; S102-N106 WeakPolarHBondContact O-CB 3.5Å; S102-N106 PolarHBondContact O-N 3.13Å; S102-N106 PolarHBondContact O-ND2 3.22Å
103	E	73.5	Confident	66	Low	140 Å²	140	119 Å²	119	65%	0.654	61%	0.613	S	S	*	*	H	α-helix	trans	-68.8	-40.2	173.5	-70.2	-164.8	172.6	0	0	111.8	D99 D100 N106 C107	D99-E103 PolarHBondContact O-N 3.05Å; D99-E103 VanDerWaalsContact O-N 3.12Å; D100-E103 PolarHBondContact O-N 3.03Å; E103-N106 PolarHBondContact O-N 3.37Å; E103-C107 WeakPolarHBondContact O-CB 3.28Å; E103-C107 PolarHBondContact O-N 3.03Å
104	I	75.3	Confident	66.6	Low	95 Å²	95	118.4 Å²	118.4	49%	0.487	61%	0.608	S	S	.	*	H	α-helix	trans	-63.4	-46.8	174	-68	162.9	0	0	0	110.2	D100 D101 N106 C107 I108	D100-I104 WeakPolarHBondContact O-CB 3.32Å; D100-I104 WeakPolarHBondContact O-CD1 3.44Å; D100-I104 WeakPolarHBondContact O-CG1 3.4Å; D100-I104 PolarHBondContact O-N 3.48Å; D101-I104 PolarHBondContact O-N 3.32Å; I104-N106 VanDerWaalsContact C-N 3.34Å; I104-N106 PolarHBondContact O-N 3.33Å; I104-C107 WeakPolarHBondContact O-CB 3.25Å; I104-C107 PolarHBondContact O-N 2.97Å; I104-C107 VanDerWaalsContact O-N 3.13Å; I104-I108 HydrophobicContact CG2-CD1 3.82Å; I104-I108 HydrophobicContact CG2-CG1 4.41Å; I104-I108 VanDerWaalsContact O-CG1 3.3Å; I104-I108 WeakPolarHBondContact O-CG1 3.44Å; I104-I108 PolarHBondContact O-N 3.37Å
105	E	76.8	Confident	66.5	Low	125 Å²	125	120.2 Å²	120.2	58%	0.584	60%	0.604	S	S	*	*	H	α-helix	trans	-61	-42.5	176.1	-80.7	-164.9	170.1	0	0	111.9	D101 C107 I108 N109	D101-E105 WeakPolarHBondContact O-CB 3.37Å; D101-E105 WeakPolarHBondContact O-CG 3.47Å; D101-E105 PolarHBondContact O-N 3.15Å; E105-C107 VanDerWaalsContact C-N 3.31Å; E105-C107 PolarHBondContact O-N 3.34Å; E105-I108 PolarHBondContact O-N 2.98Å; E105-N109 WeakPolarHBondContact O-CB 3.33Å; E105-N109 VanDerWaalsContact O-CG 3.26Å; E105-N109 PolarHBondContact O-N 2.9Å; E105-N109 PolarHBondContact O-ND2 3.43Å; E105-N109 VanDerWaalsContact O-ND2 3.14Å
106	N	77.4	Confident	66.5	Low	109 Å²	109	116 Å²	116	58%	0.583	60%	0.595	S	S	*	*	H	α-helix	trans	-63.8	-36.4	174.4	-82.6	-33.4	0	0	0	112.1	S102 E103 I104 K110	S102-N106 VanDerWaalsContact O-CB 3.29Å; S102-N106 WeakPolarHBondContact O-CB 3.5Å; S102-N106 PolarHBondContact O-N 3.13Å; S102-N106 PolarHBondContact O-ND2 3.22Å; E103-N106 PolarHBondContact O-N 3.37Å; I104-N106 VanDerWaalsContact C-N 3.34Å; I104-N106 PolarHBondContact O-N 3.33Å; N106-K110 WeakPolarHBondContact O-CB 3.29Å; N106-K110 PolarHBondContact O-N 3.37Å
107	C	74.3	Confident	66.4	Low	72 Å²	72	118 Å²	118	49%	0.486	61%	0.606	S	S	.	*	H	α-helix	trans	-68.2	-42.2	176	-157.8	0	0	0	0	111.7	E103 I104 E105 K110 L111	E103-C107 WeakPolarHBondContact O-CB 3.28Å; E103-C107 PolarHBondContact O-N 3.03Å; I104-C107 WeakPolarHBondContact O-CB 3.25Å; I104-C107 PolarHBondContact O-N 2.97Å; I104-C107 VanDerWaalsContact O-N 3.13Å; E105-C107 VanDerWaalsContact C-N 3.31Å; E105-C107 PolarHBondContact O-N 3.34Å; C107-K110 PolarHBondContact O-N 2.96Å; C107-L111 WeakPolarHBondContact O-CG 3.35Å; C107-L111 PolarHBondContact O-N 3.45Å
108	I	77.1	Confident	66	Low	84 Å²	84	115 Å²	115	43%	0.431	59%	0.591	S	S	.	*	H	α-helix	trans	-61.4	-47.7	173.6	-67.9	166.7	0	0	0	110.3	I104 E105 K110 L111 L112	I104-I108 HydrophobicContact CG2-CD1 3.82Å; I104-I108 HydrophobicContact CG2-CG1 4.41Å; I104-I108 VanDerWaalsContact O-CG1 3.3Å; I104-I108 WeakPolarHBondContact O-CG1 3.44Å; I104-I108 PolarHBondContact O-N 3.37Å; E105-I108 PolarHBondContact O-N 2.98Å; I108-K110 VanDerWaalsContact C-N 3.3Å; I108-K110 PolarHBondContact O-N 2.96Å; I108-L111 PolarHBondContact O-N 3.49Å; I108-L111 VanDerWaalsContact O-N 3.15Å; I108-L112 HydrophobicContact CG2-CD1 3.85Å; I108-L112 HydrophobicContact CG2-CG 4.41Å; I108-L112 WeakPolarHBondContact O-CB 3.4Å; I108-L112 WeakPolarHBondContact O-CG 3.48Å; I108-L112 PolarHBondContact O-N 3.28Å
109	N	72.7	Confident	65.6	Low	89 Å²	89	112.7 Å²	112.7	48%	0.476	59%	0.588	S	S	.	*	H	α-helix	trans	-64.2	-34.3	177.7	-73.6	-33	0	0	0	112.3	E105 S113	E105-N109 WeakPolarHBondContact O-CB 3.33Å; E105-N109 VanDerWaalsContact O-CG 3.26Å; E105-N109 PolarHBondContact O-N 2.9Å; E105-N109 PolarHBondContact O-ND2 3.43Å; E105-N109 VanDerWaalsContact O-ND2 3.14Å; N109-S113 VanDerWaalsContact O-CB 3.27Å; N109-S113 WeakPolarHBondContact O-CB 3.48Å; N109-S113 PolarHBondContact O-N 2.95Å; N109-S113 PolarHBondContact O-OG 3Å
110	K	77.5	Confident	65.1	Low	130 Å²	130	112.5 Å²	112.5	57%	0.565	59%	0.593	S	S	*	*	H	α-helix	trans	-69.8	-34.6	173.6	-164	171.5	-173.3	175.3	0	112.4	N106 C107 I108 S113 K114	N106-K110 WeakPolarHBondContact O-CB 3.29Å; N106-K110 PolarHBondContact O-N 3.37Å; C107-K110 PolarHBondContact O-N 2.96Å; I108-K110 VanDerWaalsContact C-N 3.3Å; I108-K110 PolarHBondContact O-N 2.96Å; K110-S113 WeakPolarHBondContact CA-OG 3.37Å; K110-S113 PolarHBondContact O-OG 2.95Å; K110-K114 WeakPolarHBondContact O-CB 3.39Å; K110-K114 WeakPolarHBondContact O-CG 3.35Å; K110-K114 PolarHBondContact O-N 3.23Å; K110-K114 VanDerWaalsContact O-N 3.13Å
111	L	67.9	Low	65	Low	118 Å²	118	111 Å²	111	62%	0.618	58%	0.584	S	S	*	*	H	α-helix	trans	-71.8	-38.8	173.8	-75.6	168.2	0	0	0	112	C107 I108 R115	C107-L111 WeakPolarHBondContact O-CG 3.35Å; C107-L111 PolarHBondContact O-N 3.45Å; I108-L111 PolarHBondContact O-N 3.49Å; I108-L111 VanDerWaalsContact O-N 3.15Å; L111-R115 PolarHBondContact O-N 3.44Å
112	L	66.4	Low	65	Low	97 Å²	97	110.2 Å²	110.2	51%	0.508	58%	0.58	S	S	.	*	H	α-helix	trans	-70.8	-37.8	175.8	-70.1	170.6	0	0	0	112.1	I108 R115	I108-L112 HydrophobicContact CG2-CD1 3.85Å; I108-L112 HydrophobicContact CG2-CG 4.41Å; I108-L112 WeakPolarHBondContact O-CB 3.4Å; I108-L112 WeakPolarHBondContact O-CG 3.48Å; I108-L112 PolarHBondContact O-N 3.28Å; L112-R115 WeakPolarHBondContact O-CB 3.34Å; L112-R115 PolarHBondContact O-N 2.8Å
113	S	65	Low	65.6	Low	91 Å²	91	114.9 Å²	114.9	64%	0.636	59%	0.594	S	S	*	*	H	α-helix	trans	-77.1	-24.5	178.5	56.1	0	0	0	0	114.3	N109 K110 R115	N109-S113 VanDerWaalsContact O-CB 3.27Å; N109-S113 WeakPolarHBondContact O-CB 3.48Å; N109-S113 PolarHBondContact O-N 2.95Å; N109-S113 PolarHBondContact O-OG 3Å; K110-S113 WeakPolarHBondContact CA-OG 3.37Å; K110-S113 PolarHBondContact O-OG 2.95Å; S113-R115 VanDerWaalsContact C-N 3.3Å
114	K	61.6	Low	66	Low	160 Å²	160	116 Å²	116	70%	0.696	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.6	-10.3	170.1	-77.5	-175.3	177.7	-173.1	0	113.5	K110 P116	K110-K114 WeakPolarHBondContact O-CB 3.39Å; K110-K114 WeakPolarHBondContact O-CG 3.35Å; K110-K114 PolarHBondContact O-N 3.23Å; K110-K114 VanDerWaalsContact O-N 3.13Å; K114-P116 WeakPolarHBondContact O-CD 3.41Å
115	R	52.5	Low	66.5	Low	176 Å²	176	116.1 Å²	116.1	66%	0.664	60%	0.604	S	S	*	*	S	Bend	trans	-71.7	118.7	164	-79.2	-177.4	178.6	163.6	1	106.6	L111 L112 S113 N117	L111-R115 PolarHBondContact O-N 3.44Å; L112-R115 WeakPolarHBondContact O-CB 3.34Å; L112-R115 PolarHBondContact O-N 2.8Å; S113-R115 VanDerWaalsContact C-N 3.3Å; R115-N117 PolarHBondContact O-N 3.46Å
116	P	53.3	Low	66.9	Low	91 Å²	91	115.5 Å²	115.5	59%	0.591	60%	0.602	S	S	*	*			trans	-52.5	147.4	164.8	25.5	-32.3	0	0	0	107.1	K114 Q118	K114-P116 WeakPolarHBondContact O-CD 3.41Å; P116-Q118 PolarHBondContact O-N 2.92Å
117	N	50	Low	67.4	Low	172 Å²	172	115.5 Å²	115.5	92%	0.92	60%	0.601	S	S	*	*	S	Bend	trans	-61.7	32.8	179.5	-60.5	-45.8	0	0	0	114.1	R115 S119	R115-N117 PolarHBondContact O-N 3.46Å; N117-S119 VanDerWaalsContact C-N 3.26Å; N117-S119 PolarHBondContact O-N 3.11Å
118	Q	49.5	Very low	68.2	Low	140 Å²	140	114 Å²	114	65%	0.654	59%	0.593	S	S	*	*			trans	-65.5	93.5	153.7	-117.6	90.8	16.8	0	0	106.5	P116 C120	P116-Q118 PolarHBondContact O-N 2.92Å; Q118-C120 PolarHBondContact O-N 3.05Å
119	S	48.5	Very low	68.9	Low	98 Å²	98	113.3 Å²	113.3	69%	0.685	59%	0.588	S	S	*	*			trans	-23.1	128.9	147.7	50.9	0	0	0	0	109.5	N117 I121	N117-S119 VanDerWaalsContact C-N 3.26Å; N117-S119 PolarHBondContact O-N 3.11Å; S119-I121 PolarHBondContact O-N 3.19Å
120	C	52	Low	69.9	Low	90 Å²	90	113 Å²	113	61%	0.608	59%	0.591	S	S	*	*			trans	-8.9	97.3	160.5	174.4	0	0	0	0	108.9	Q118 D122	Q118-C120 PolarHBondContact O-N 3.05Å; C120-D122 PolarHBondContact O-N 3.37Å
121	I	57.7	Low	70.7	Confident	95 Å²	95	114.1 Å²	114.1	49%	0.487	59%	0.592	S	S	.	*			trans	-54.1	110.1	168.6	-68.7	166.3	0	0	0	100.7	S119 F123	S119-I121 PolarHBondContact O-N 3.19Å; I121-F123 WeakPolarHBondContact O-CD2 3.38Å; I121-F123 PolarHBondContact O-N 3.47Å
122	D	68.6	Low	72	Confident	98 Å²	98	113.6 Å²	113.6	52%	0.524	59%	0.59	S	S	.	*			trans	-61	96.5	-174.4	-81.5	-27.7	0	0	0	104	C120 E124 V125 E126	C120-D122 PolarHBondContact O-N 3.37Å; D122-E124 CarbonylContact O-C 3.58Å; D122-E124 PolarHBondContact O-N 2.93Å; D122-V125 HydrophobicContact CB-CB 3.94Å; D122-V125 HydrophobicContact CB-CG2 3.56Å; D122-V125 WeakPolarHBondContact O-CA 3.18Å; D122-V125 WeakPolarHBondContact O-CB 3.47Å; D122-V125 PolarHBondContact O-N 3.14Å; D122-E126 PolarHBondContact O-N 2.72Å; D122-E126 VanDerWaalsContact O-N 3.1Å
123	F	79.3	Confident	73.3	Confident	142 Å²	142	114 Å²	114	62%	0.623	59%	0.585	S	S	*	*	H	α-helix	trans	-56.1	-29.2	-175.3	-75.6	-74.3	0	0	0	108.2	I121 E126 L127	I121-F123 WeakPolarHBondContact O-CD2 3.38Å; I121-F123 PolarHBondContact O-N 3.47Å; F123-E126 PolarHBondContact O-N 3.22Å; F123-L127 WeakPolarHBondContact O-CB 3.11Å; F123-L127 WeakPolarHBondContact O-CD1 3.33Å; F123-L127 WeakPolarHBondContact O-CG 3.38Å; F123-L127 PolarHBondContact O-N 2.91Å
124	E	82.7	Confident	74.8	Confident	165 Å²	165	114.5 Å²	114.5	77%	0.771	58%	0.579	S	S	*	*	H	α-helix	trans	-59.4	-43.6	170.3	-59.8	-171.1	174.6	0	0	113.8	D122 A128	D122-E124 CarbonylContact O-C 3.58Å; D122-E124 PolarHBondContact O-N 2.93Å; E124-A128 WeakPolarHBondContact O-CB 3.06Å; E124-A128 PolarHBondContact O-N 2.87Å
125	V	85.1	Confident	76.4	Confident	96 Å²	96	112.3 Å²	112.3	58%	0.582	57%	0.572	S	S	*	*	H	α-helix	trans	-68.1	-44.3	176.9	176.3	0	0	0	0	110.8	D122 A128 K129	D122-V125 HydrophobicContact CB-CB 3.94Å; D122-V125 HydrophobicContact CB-CG2 3.56Å; D122-V125 WeakPolarHBondContact O-CA 3.18Å; D122-V125 WeakPolarHBondContact O-CB 3.47Å; D122-V125 PolarHBondContact O-N 3.14Å; V125-A128 PolarHBondContact O-N 2.8Å; V125-K129 WeakPolarHBondContact O-CB 3.46Å; V125-K129 PolarHBondContact O-N 3.41Å
126	E	85.2	Confident	78.4	Confident	113 Å²	113	105.8 Å²	105.8	53%	0.528	56%	0.555	S	S	.	*	H	α-helix	trans	-67	-40.3	177.4	-168.7	177.4	-176.1	0	0	111.8	D122 F123 K129 C130	D122-E126 PolarHBondContact O-N 2.72Å; D122-E126 VanDerWaalsContact O-N 3.1Å; F123-E126 PolarHBondContact O-N 3.22Å; E126-K129 WeakPolarHBondContact O-CB 3.31Å; E126-K129 PolarHBondContact O-N 3.49Å; E126-C130 WeakPolarHBondContact O-CB 3.47Å; E126-C130 PolarHBondContact O-N 3.36Å
127	L	88.5	Confident	80.5	Confident	108 Å²	108	106.4 Å²	106.4	57%	0.565	55%	0.547	S	S	*	.	H	α-helix	trans	-64.9	-40.3	174.3	-76	169.4	0	0	0	111.8	F123 K129 C130 R131	F123-L127 WeakPolarHBondContact O-CB 3.11Å; F123-L127 WeakPolarHBondContact O-CD1 3.33Å; F123-L127 WeakPolarHBondContact O-CG 3.38Å; F123-L127 PolarHBondContact O-N 2.91Å; L127-K129 VanDerWaalsContact C-N 3.32Å; L127-C130 PolarHBondContact O-N 3.32Å; L127-R131 VanDerWaalsContact O-CB 3.31Å; L127-R131 WeakPolarHBondContact O-CB 3.48Å; L127-R131 PolarHBondContact O-N 3.37Å
128	A	91	Very high	82.6	Confident	40 Å²	40	101.4 Å²	101.4	33%	0.331	52%	0.52	S	S	.	.	H	α-helix	trans	-61.9	-42.7	174.3	0	0	0	0	0	110.9	E124 V125 R131 N132	E124-A128 WeakPolarHBondContact O-CB 3.06Å; E124-A128 PolarHBondContact O-N 2.87Å; V125-A128 PolarHBondContact O-N 2.8Å; A128-R131 PolarHBondContact O-N 3.13Å; A128-N132 VanDerWaalsContact O-CG 3.22Å; A128-N132 PolarHBondContact O-N 3.47Å; A128-N132 PolarHBondContact O-ND2 3.48Å
129	K	93	Very high	84.8	Confident	71 Å²	71	100.4 Å²	100.4	31%	0.309	52%	0.515	S	S	.	.	H	α-helix	trans	-63.5	-44.1	175.1	-179	169.2	173.5	164	0	112.4	E70 V125 E126 L127 N132 R133	E70-K129 WeakPolarHBondContact OE1-CE 3.36Å; E70-K129 IonicContact OE1-NZ 3.58Å; E70-K129 PolarHBondContact OE1-NZ 3.41Å; E70-K129 WeakPolarHBondContact OE2-CE 3.45Å; E70-K129 IonicContact OE2-NZ 3.63Å; E70-K129 PolarHBondContact OE2-NZ 3.37Å; V125-K129 WeakPolarHBondContact O-CB 3.46Å; V125-K129 PolarHBondContact O-N 3.41Å; E126-K129 WeakPolarHBondContact O-CB 3.31Å; E126-K129 PolarHBondContact O-N 3.49Å; L127-K129 VanDerWaalsContact C-N 3.32Å; K129-N132 PolarHBondContact O-N 3.44Å; K129-R133 WeakPolarHBondContact O-CG 3.43Å; K129-R133 PolarHBondContact O-N 2.96Å
130	C	92	Very high	87	Confident	81 Å²	81	98.3 Å²	98.3	55%	0.547	50%	0.504	S	S	.	.	H	α-helix	trans	-61.5	-44.5	175.4	-176.5	0	0	0	0	111.5	E126 L127 N132 R133 L134	E126-C130 WeakPolarHBondContact O-CB 3.47Å; E126-C130 PolarHBondContact O-N 3.36Å; L127-C130 PolarHBondContact O-N 3.32Å; C130-N132 PolarHBondContact O-N 3.03Å; C130-R133 PolarHBondContact O-N 3.31Å; C130-L134 PolarHBondContact O-N 3.27Å
131	R	94.6	Very high	89	Confident	155 Å²	155	97.3 Å²	97.3	59%	0.585	49%	0.489	S	S	*	.	H	α-helix	trans	-59.7	-47	176.7	-176	-175.2	-61.5	158.9	3.1	111.8	L127 A128 R133 L134 H135	L127-R131 VanDerWaalsContact O-CB 3.31Å; L127-R131 WeakPolarHBondContact O-CB 3.48Å; L127-R131 PolarHBondContact O-N 3.37Å; A128-R131 PolarHBondContact O-N 3.13Å; R131-R133 VanDerWaalsContact C-N 3.34Å; R131-R133 PolarHBondContact O-N 2.97Å; R131-L134 PolarHBondContact O-N 2.84Å; R131-H135 PolarHBondContact O-CD2 3.45Å; R131-H135 PolarHBondContact O-N 2.93Å
132	N	94.6	Very high	90.8	Very high	106 Å²	106	97.5 Å²	97.5	57%	0.567	49%	0.491	S	S	*	.	H	α-helix	trans	-63	-41.8	179.1	-69.9	-12.6	0	0	0	111.7	A128 K129 C130 L134 H135 A136	A128-N132 VanDerWaalsContact O-CG 3.22Å; A128-N132 PolarHBondContact O-N 3.47Å; A128-N132 PolarHBondContact O-ND2 3.48Å; K129-N132 PolarHBondContact O-N 3.44Å; C130-N132 PolarHBondContact O-N 3.03Å; N132-L134 PolarHBondContact O-N 3.04Å; N132-H135 PolarHBondContact O-N 3.44Å; N132-A136 WeakPolarHBondContact O-CB 3.36Å; N132-A136 PolarHBondContact O-N 2.8Å
133	R	95.1	Very high	92	Very high	107 Å²	107	95.4 Å²	95.4	40%	0.404	48%	0.484	S	S	.	.	H	α-helix	trans	-62.5	-41.7	175.6	-73.8	175.5	177.7	-167.9	-6.8	112.2	E70 K129 C130 R131 A136 Y137	E70-R133 IonicContact OE2-CZ 3.99Å; E70-R133 IonicContact OE2-NH2 2.72Å; E70-R133 PolarHBondContact OE2-NH2 3.4Å; K129-R133 WeakPolarHBondContact O-CG 3.43Å; K129-R133 PolarHBondContact O-N 2.96Å; C130-R133 PolarHBondContact O-N 3.31Å; R131-R133 VanDerWaalsContact C-N 3.34Å; R131-R133 PolarHBondContact O-N 2.97Å; R133-A136 PolarHBondContact O-N 3.12Å; R133-Y137 WeakPolarHBondContact O-CB 3.05Å; R133-Y137 PolarHBondContact O-N 2.86Å
134	L	95.1	Very high	92.7	Very high	101 Å²	101	91.6 Å²	91.6	53%	0.529	47%	0.474	S	S	.	.	H	α-helix	trans	-64.6	-42.3	176.9	-176.5	64.3	0	0	0	111.8	C130 R131 N132 Y137 N138	C130-L134 PolarHBondContact O-N 3.27Å; R131-L134 PolarHBondContact O-N 2.84Å; N132-L134 PolarHBondContact O-N 3.04Å; L134-Y137 PolarHBondContact O-N 2.91Å; L134-N138 WeakPolarHBondContact O-CB 3.35Å; L134-N138 VanDerWaalsContact O-CG 3.28Å; L134-N138 PolarHBondContact O-N 3.3Å
135	H	95.9	Very high	93.1	Very high	114 Å²	114	87.6 Å²	87.6	53%	0.528	46%	0.457	S	S	.	.	H	α-helix	trans	-61.5	-48.1	175.1	-76.3	-57.9	0	0	0	111.9	R131 N132 Y137 N138 E139	R131-H135 PolarHBondContact O-CD2 3.45Å; R131-H135 PolarHBondContact O-N 2.93Å; N132-H135 PolarHBondContact O-N 3.44Å; H135-Y137 VanDerWaalsContact C-N 3.34Å; H135-Y137 PolarHBondContact O-N 2.67Å; H135-N138 PolarHBondContact O-N 3.44Å; H135-E139 WeakPolarHBondContact O-CB 3.33Å; H135-E139 PolarHBondContact O-N 3.19Å
136	A	95.3	Very high	93.5	Very high	39 Å²	39	85.6 Å²	85.6	32%	0.322	44%	0.443	S	S	.	.	H	α-helix	trans	-61.1	-42	178.1	0	0	0	0	0	112.2	N132 R133 A140	N132-A136 WeakPolarHBondContact O-CB 3.36Å; N132-A136 PolarHBondContact O-N 2.8Å; R133-A136 PolarHBondContact O-N 3.12Å; A136-A140 WeakPolarHBondContact O-CB 3.39Å; A136-A140 PolarHBondContact O-N 3.45Å
137	Y	96	Very high	93.9	Very high	104 Å²	104	85.5 Å²	85.5	41%	0.408	45%	0.445	S	S	.	.	H	α-helix	trans	-61.9	-45.5	175.1	167.7	-89.4	0	0	0	111.6	R133 L134 H135 A140 K141 D172	R133-Y137 WeakPolarHBondContact O-CB 3.05Å; R133-Y137 PolarHBondContact O-N 2.86Å; L134-Y137 PolarHBondContact O-N 2.91Å; H135-Y137 VanDerWaalsContact C-N 3.34Å; H135-Y137 PolarHBondContact O-N 2.67Å; Y137-A140 PolarHBondContact O-N 3.33Å; Y137-K141 HydrophobicContact CE1-CD 3.8Å; Y137-K141 VanDerWaalsContact O-CB 3.3Å; Y137-K141 WeakPolarHBondContact O-CB 3.45Å; Y137-K141 PolarHBondContact O-N 2.89Å; Y137-K141 WeakPolarHBondContact OH-CD 3.21Å; Y137-K141 PolarHBondContact OH-NZ 3.13Å; Y137-D172 PolarHBondContact OH-O 3.43Å
138	N	95.1	Very high	94.2	Very high	67 Å²	67	81.5 Å²	81.5	36%	0.358	42%	0.423	S	S	.	.	H	α-helix	trans	-63.9	-44.3	179.5	-73.7	-14.9	0	0	0	111.7	L134 H135 A140 K141 D142	L134-N138 WeakPolarHBondContact O-CB 3.35Å; L134-N138 VanDerWaalsContact O-CG 3.28Å; L134-N138 PolarHBondContact O-N 3.3Å; H135-N138 PolarHBondContact O-N 3.44Å; N138-A140 VanDerWaalsContact C-N 3.34Å; N138-A140 PolarHBondContact O-N 3.05Å; N138-K141 PolarHBondContact O-N 3.09Å; N138-D142 WeakPolarHBondContact O-CB 3.21Å; N138-D142 VanDerWaalsContact O-CG 3.29Å; N138-D142 PolarHBondContact O-N 3.48Å
139	E	95.8	Very high	94.3	Very high	119 Å²	119	81.2 Å²	81.2	56%	0.556	42%	0.424	S	S	*	.	H	α-helix	trans	-61.8	-42.6	177.9	-174.2	177.5	179.4	0	0	111.8	H135 S143	H135-E139 WeakPolarHBondContact O-CB 3.33Å; H135-E139 PolarHBondContact O-N 3.19Å; E139-S143 WeakPolarHBondContact O-CB 3.33Å; E139-S143 PolarHBondContact O-N 3.48Å; E139-S143 PolarHBondContact O-OG 3.46Å
140	A	95	Very high	94.4	Very high	54 Å²	54	80.1 Å²	80.1	45%	0.446	42%	0.422	S	S	.	.	H	α-helix	trans	-64	-44.7	174.1	0	0	0	0	0	111.7	A136 Y137 N138 S143 C144	A136-A140 WeakPolarHBondContact O-CB 3.39Å; A136-A140 PolarHBondContact O-N 3.45Å; Y137-A140 PolarHBondContact O-N 3.33Å; N138-A140 VanDerWaalsContact C-N 3.34Å; N138-A140 PolarHBondContact O-N 3.05Å; A140-S143 WeakPolarHBondContact O-CB 3.47Å; A140-S143 PolarHBondContact O-N 2.85Å; A140-C144 WeakPolarHBondContact O-CB 3.47Å; A140-C144 PolarHBondContact O-N 2.92Å; A140-C144 PolarHBondContact O-SG 3.45Å
141	K	92.9	Very high	94.5	Very high	68 Å²	68	78.4 Å²	78.4	30%	0.296	41%	0.407	S	S	.	.	H	α-helix	trans	-60.9	-47	178.7	-178.3	163.9	-176	150.2	0	111.6	Y137 N138 S143 C144 I145 D172	Y137-K141 HydrophobicContact CE1-CD 3.8Å; Y137-K141 VanDerWaalsContact O-CB 3.3Å; Y137-K141 WeakPolarHBondContact O-CB 3.45Å; Y137-K141 PolarHBondContact O-N 2.89Å; Y137-K141 WeakPolarHBondContact OH-CD 3.21Å; Y137-K141 PolarHBondContact OH-NZ 3.13Å; N138-K141 PolarHBondContact O-N 3.09Å; K141-S143 VanDerWaalsContact C-N 3.34Å; K141-S143 PolarHBondContact O-N 3.38Å; K141-C144 PolarHBondContact O-N 3.01Å; K141-I145 HydrophobicContact CG-CD1 3.91Å; K141-I145 VanDerWaalsContact O-CG1 3.29Å; K141-I145 WeakPolarHBondContact O-CG1 3.37Å; K141-I145 PolarHBondContact O-N 3.25Å; K141-D172 PolarHBondContact NZ-O 3.01Å; K141-D172 PolarHBondContact NZ-OXT 3.02Å
142	D	95.2	Very high	94.4	Very high	99 Å²	99	71.3 Å²	71.3	53%	0.529	38%	0.382	S	S	.	.	H	α-helix	trans	-61.5	-44.4	178.1	-71.4	-17.1	0	0	0	110.9	N138 C144 I145 I146	N138-D142 WeakPolarHBondContact O-CB 3.21Å; N138-D142 VanDerWaalsContact O-CG 3.29Å; N138-D142 PolarHBondContact O-N 3.48Å; D142-C144 PolarHBondContact O-N 3.12Å; D142-I145 PolarHBondContact O-N 2.92Å; D142-I146 WeakPolarHBondContact O-CG1 3.3Å; D142-I146 PolarHBondContact O-N 3.43Å; D142-I146 VanDerWaalsContact O-N 3.08Å
143	S	94.8	Very high	94.4	Very high	55 Å²	55	71.4 Å²	71.4	39%	0.385	38%	0.382	S	S	.	.	H	α-helix	trans	-59.7	-44.7	175.6	-60.3	0	0	0	0	112.2	E139 A140 K141 I146 L147	E139-S143 WeakPolarHBondContact O-CB 3.33Å; E139-S143 PolarHBondContact O-N 3.48Å; E139-S143 PolarHBondContact O-OG 3.46Å; A140-S143 WeakPolarHBondContact O-CB 3.47Å; A140-S143 PolarHBondContact O-N 2.85Å; K141-S143 VanDerWaalsContact C-N 3.34Å; K141-S143 PolarHBondContact O-N 3.38Å; S143-I146 PolarHBondContact O-N 3.13Å; S143-L147 PolarHBondContact O-N 2.85Å
144	C	93	Very high	94.4	Very high	62 Å²	62	72.8 Å²	72.8	42%	0.419	40%	0.397	S	S	.	.	H	α-helix	trans	-65.2	-40.7	177.3	-73.5	0	0	0	0	112.3	A140 K141 D142 I146 L147 F148	A140-C144 WeakPolarHBondContact O-CB 3.47Å; A140-C144 PolarHBondContact O-N 2.92Å; A140-C144 PolarHBondContact O-SG 3.45Å; K141-C144 PolarHBondContact O-N 3.01Å; D142-C144 PolarHBondContact O-N 3.12Å; C144-I146 VanDerWaalsContact C-N 3.33Å; C144-I146 PolarHBondContact O-N 3.45Å; C144-L147 PolarHBondContact O-N 2.87Å; C144-F148 WeakPolarHBondContact O-CB 3.36Å; C144-F148 WeakPolarHBondContact O-CD2 3.29Å; C144-F148 WeakPolarHBondContact O-CG 3.44Å; C144-F148 PolarHBondContact O-N 3.33Å
145	I	91.4	Very high	94.3	Very high	80 Å²	80	74.1 Å²	74.1	41%	0.41	40%	0.395	S	S	.	.	H	α-helix	trans	-61.5	-43.5	177.3	-71.7	166.6	0	0	0	110.6	K141 D142 F148 G149	K141-I145 HydrophobicContact CG-CD1 3.91Å; K141-I145 VanDerWaalsContact O-CG1 3.29Å; K141-I145 WeakPolarHBondContact O-CG1 3.37Å; K141-I145 PolarHBondContact O-N 3.25Å; D142-I145 PolarHBondContact O-N 2.92Å; I145-F148 PolarHBondContact O-N 2.85Å; I145-G149 PolarHBondContact O-N 2.63Å
146	I	93.6	Very high	94.2	Very high	54 Å²	54	72.1 Å²	72.1	28%	0.277	41%	0.405	S	S	.	.	H	α-helix	trans	-60.9	-48.7	175.8	-66.3	167.4	0	0	0	110.1	I51 D142 S143 C144 F148 G149 L150	I51-I146 HydrophobicContact CD1-CD1 3.88Å; D142-I146 WeakPolarHBondContact O-CG1 3.3Å; D142-I146 PolarHBondContact O-N 3.43Å; D142-I146 VanDerWaalsContact O-N 3.08Å; S143-I146 PolarHBondContact O-N 3.13Å; C144-I146 VanDerWaalsContact C-N 3.33Å; C144-I146 PolarHBondContact O-N 3.45Å; I146-F148 PolarHBondContact O-N 3.15Å; I146-G149 PolarHBondContact O-N 3.1Å; I146-L150 HydrophobicContact CG2-CD1 4.31Å; I146-L150 WeakPolarHBondContact O-CG 3.33Å; I146-L150 PolarHBondContact O-N 3.14Å
147	L	94.2	Very high	94.1	Very high	111 Å²	111	71.8 Å²	71.8	58%	0.581	40%	0.401	S	S	*	.	H	α-helix	trans	-61.2	-43	-179.9	-176.6	61.4	0	0	0	112.1	S143 C144 L150 L151	S143-L147 PolarHBondContact O-N 2.85Å; C144-L147 PolarHBondContact O-N 2.87Å; L147-L150 PolarHBondContact O-N 2.73Å; L147-L151 WeakPolarHBondContact O-CB 3.49Å; L147-L151 PolarHBondContact O-N 2.96Å
148	F	94	Very high	93.8	Very high	24 Å²	24	71.1 Å²	71.1	11%	0.105	40%	0.404	C	S	.	.	H	α-helix	trans	-67.4	-36	175.6	-73.7	-38.8	0	0	0	112.6	C144 I145 I146 L150 L151 A152 V159 L162 Y163 F166 L168	C144-F148 WeakPolarHBondContact O-CB 3.36Å; C144-F148 WeakPolarHBondContact O-CD2 3.29Å; C144-F148 WeakPolarHBondContact O-CG 3.44Å; C144-F148 PolarHBondContact O-N 3.33Å; I145-F148 PolarHBondContact O-N 2.85Å; I146-F148 PolarHBondContact O-N 3.15Å; F148-L150 VanDerWaalsContact C-N 3.33Å; F148-L150 PolarHBondContact O-N 3.39Å; F148-L151 HydrophobicContact CD1-CD2 4.48Å; F148-L151 PolarHBondContact O-N 2.86Å; F148-A152 WeakPolarHBondContact O-CB 3.4Å; F148-A152 PolarHBondContact O-N 2.79Å; F148-V159 HydrophobicContact CB-CG1 4.08Å; F148-L162 HydrophobicContact CB-CD1 4.32Å; F148-L162 HydrophobicContact CD1-CB 4.43Å; F148-L162 HydrophobicContact CD1-CD1 4.15Å; F148-L162 WeakPolarHBondContact O-CD1 3.4Å; F148-Y163 AromaticContact CD2-CE2 3.89Å; F148-Y163 HydrophobicContact CD2-CE2 3.89Å; F148-Y163 HydrophobicContact CE2-CE2 4.22Å; F148-F166 HydrophobicContact CD1-CE2 4.46Å; F148-F166 AromaticContact CE1-CD2 3.67Å; F148-F166 HydrophobicContact CE1-CD2 3.67Å; F148-F166 AromaticContact CE1-CE2 3.79Å; F148-F166 HydrophobicContact CE1-CE2 3.79Å; F148-F166 HydrophobicContact CZ-CD2 4.18Å; F148-L168 HydrophobicContact CE2-CD1 3.7Å; F148-L168 HydrophobicContact CZ-CD1 3.47Å; F148-L168 VanDerWaalsContact CZ-CD1 3.47Å
149	G	93.8	Very high	93.6	Very high	34 Å²	34	70.7 Å²	70.7	35%	0.351	40%	0.403	S	S	.	.	H	α-helix	trans	-59	-45	172.3	0	0	0	0	0	112	I145 I146 N153	I145-G149 PolarHBondContact O-N 2.63Å; I146-G149 PolarHBondContact O-N 3.1Å; G149-N153 WeakPolarHBondContact O-CB 3.49Å; G149-N153 PolarHBondContact O-N 3.15Å
150	L	94	Very high	93.4	Very high	48 Å²	48	72.8 Å²	72.8	25%	0.251	41%	0.406	S	S	.	.	H	α-helix	trans	-66.2	-44.2	176.2	-66.5	174.4	0	0	0	112.2	I44 I146 L147 F148 N153 N154	I44-L150 HydrophobicContact CD1-CD2 3.94Å; I44-L150 HydrophobicContact CG1-CD2 4.47Å; I44-L150 HydrophobicContact CG2-CD2 3.74Å; I146-L150 HydrophobicContact CG2-CD1 4.31Å; I146-L150 WeakPolarHBondContact O-CG 3.33Å; I146-L150 PolarHBondContact O-N 3.14Å; L147-L150 PolarHBondContact O-N 2.73Å; F148-L150 VanDerWaalsContact C-N 3.33Å; F148-L150 PolarHBondContact O-N 3.39Å; L150-N153 PolarHBondContact O-N 2.86Å; L150-N154 PolarHBondContact O-N 3.05Å; L150-N154 PolarHBondContact O-ND2 2.76Å
151	L	94	Very high	93.1	Very high	46 Å²	46	74.4 Å²	74.4	24%	0.241	41%	0.405	C	S	.	.	H	α-helix	trans	-64.6	-42.8	179.6	-173.7	63.5	0	0	0	111.6	L147 F148 N154 R155 L162 F166	L147-L151 WeakPolarHBondContact O-CB 3.49Å; L147-L151 PolarHBondContact O-N 2.96Å; F148-L151 HydrophobicContact CD1-CD2 4.48Å; F148-L151 PolarHBondContact O-N 2.86Å; L151-N154 PolarHBondContact O-N 2.87Å; L151-R155 WeakPolarHBondContact O-CB 3.21Å; L151-R155 WeakPolarHBondContact O-CG 3.33Å; L151-R155 PolarHBondContact O-N 3.23Å; L151-L162 HydrophobicContact CB-CD1 4.05Å; L151-L162 HydrophobicContact CD2-CD1 4.07Å; L151-L162 HydrophobicContact CD2-CD2 4.07Å; L151-L162 HydrophobicContact CG-CD1 4.09Å; L151-L162 HydrophobicContact CG-CD2 4.28Å; L151-F166 HydrophobicContact CD2-CE2 3.86Å; L151-F166 HydrophobicContact CD2-CZ 4.02Å
152	A	94.1	Very high	93	Very high	6 Å²	6	71.2 Å²	71.2	5%	0.05	39%	0.39	C	S	.	.	H	α-helix	trans	-62.7	-43.8	177.3	0	0	0	0	0	111.1	F148 N154 R155 G156 C157 V159 L162	F148-A152 WeakPolarHBondContact O-CB 3.4Å; F148-A152 PolarHBondContact O-N 2.79Å; A152-N154 PolarHBondContact O-N 3.29Å; A152-R155 PolarHBondContact O-N 3.48Å; A152-G156 PolarHBondContact O-N 2.77Å; A152-C157 WeakPolarHBondContact CB-O 3.37Å; A152-C157 PolarHBondContact O-N 3.34Å; A152-C157 VanDerWaalsContact O-N 3.12Å; A152-V159 HydrophobicContact CB-CG2 3.72Å; A152-L162 HydrophobicContact CB-CD1 3.76Å
153	N	94	Very high	92.8	Very high	108 Å²	108	68.3 Å²	68.3	58%	0.578	37%	0.373	S	S	*	.	H	α-helix	trans	-61	-44.9	175.9	-169.2	27.8	0	0	0	111.8	G149 L150 R155 G156	G149-N153 WeakPolarHBondContact O-CB 3.49Å; G149-N153 PolarHBondContact O-N 3.15Å; L150-N153 PolarHBondContact O-N 2.86Å; N153-R155 VanDerWaalsContact C-N 3.33Å; N153-R155 PolarHBondContact O-N 3.13Å; N153-G156 PolarHBondContact O-N 2.86Å
154	N	94.2	Very high	92.5	Very high	136 Å²	136	70 Å²	70	73%	0.727	38%	0.384	S	S	*	.	H	α-helix	trans	-66.4	-33.1	178.5	-73.9	-22.6	0	0	0	113.3	L150 L151 A152	L150-N154 PolarHBondContact O-N 3.05Å; L150-N154 PolarHBondContact O-ND2 2.76Å; L151-N154 PolarHBondContact O-N 2.87Å; A152-N154 PolarHBondContact O-N 3.29Å
155	R	93.3	Very high	92.3	Very high	128 Å²	128	72.4 Å²	72.4	48%	0.483	39%	0.389	S	S	.	.	H	α-helix	trans	-87.4	-13	178.8	-72.2	-177.1	172.9	-168	-3.1	113.7	L151 A152 N153 C157 E165	L151-R155 WeakPolarHBondContact O-CB 3.21Å; L151-R155 WeakPolarHBondContact O-CG 3.33Å; L151-R155 PolarHBondContact O-N 3.23Å; A152-R155 PolarHBondContact O-N 3.48Å; N153-R155 VanDerWaalsContact C-N 3.33Å; N153-R155 PolarHBondContact O-N 3.13Å; R155-C157 VanDerWaalsContact C-N 3.25Å; R155-C157 HydrophobicContact CB-CB 4.48Å; R155-C157 PolarHBondContact O-N 3.4Å; R155-E165 IonicContact CZ-OE1 3.89Å; R155-E165 IonicContact CZ-OE2 2.76Å; R155-E165 IonicContact NH1-OE1 3.44Å; R155-E165 PolarHBondContact NH1-OE1 3.17Å; R155-E165 IonicContact NH1-OE2 3.96Å; R155-E165 PolarHBondContact NH1-OE2 2.93Å; R155-E165 IonicContact NH2-OE1 2.93Å
156	G	93.4	Very high	92.2	Very high	72 Å²	72	73.2 Å²	73.2	74%	0.742	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.1	28.1	-173.6	0	0	0	0	0	113.1	A152 N153	A152-G156 PolarHBondContact O-N 2.77Å; N153-G156 PolarHBondContact O-N 2.86Å
157	C	93.3	Very high	92	Very high	33 Å²	33	78 Å²	78	22%	0.223	42%	0.416	C	S	.	.	S	Bend	trans	-114.3	171.4	179.2	68.1	0	0	0	0	111.2	A152 R155 E161	A152-C157 WeakPolarHBondContact CB-O 3.37Å; A152-C157 PolarHBondContact O-N 3.34Å; A152-C157 VanDerWaalsContact O-N 3.12Å; R155-C157 VanDerWaalsContact C-N 3.25Å; R155-C157 HydrophobicContact CB-CB 4.48Å; R155-C157 PolarHBondContact O-N 3.4Å; C157-E161 WeakPolarHBondContact CB-OE2 3.27Å
158	L	91.2	Very high	91.7	Very high	90 Å²	90	76.3 Å²	76.3	47%	0.471	41%	0.407	S	S	.	.			trans	-87.7	147.1	173.7	-69.4	167.3	0	0	0	110.4	R160 E161	L158-R160 HydrophobicContact CB-CG 3.98Å; L158-R160 PolarHBondContact O-N 2.91Å; L158-R160 VanDerWaalsContact O-N 3.15Å; L158-E161 HydrophobicContact CB-CG 4.5Å; L158-E161 PolarHBondContact N-OE2 2.99Å; L158-E161 WeakPolarHBondContact O-CB 3.35Å; L158-E161 PolarHBondContact O-N 3.44Å
159	V	90.7	Very high	91.2	Very high	57 Å²	57	80.2 Å²	80.2	35%	0.345	43%	0.429	S	S	.	.	H	α-helix	trans	-53.2	-40.4	179.1	172.9	0	0	0	0	112	F148 A152 E161 L162 Y163	F148-V159 HydrophobicContact CB-CG1 4.08Å; A152-V159 HydrophobicContact CB-CG2 3.72Å; V159-E161 PolarHBondContact O-N 3.28Å; V159-E161 VanDerWaalsContact O-N 3.12Å; V159-L162 WeakPolarHBondContact O-CA 3.49Å; V159-L162 VanDerWaalsContact O-CB 3.3Å; V159-L162 WeakPolarHBondContact O-CB 3.42Å; V159-L162 PolarHBondContact O-N 3.2Å; V159-Y163 HydrophobicContact CG1-CD2 3.87Å; V159-Y163 HydrophobicContact CG1-CE2 3.5Å; V159-Y163 VanDerWaalsContact CG1-CE2 3.5Å; V159-Y163 WeakPolarHBondContact O-CD2 3.44Å; V159-Y163 PolarHBondContact O-N 3.27Å
160	R	90.9	Very high	90.5	Very high	163 Å²	163	84 Å²	84	62%	0.615	44%	0.441	S	S	*	.	H	α-helix	trans	-56.2	-28.6	176.7	69.2	-174.2	178.4	-169.6	-0.4	114.6	L158 S164 L170	L158-R160 HydrophobicContact CB-CG 3.98Å; L158-R160 PolarHBondContact O-N 2.91Å; L158-R160 VanDerWaalsContact O-N 3.15Å; R160-S164 PolarHBondContact O-N 2.81Å; R160-L170 HydrophobicContact CB-CD1 4.16Å
161	E	89.4	Confident	89.9	Confident	89 Å²	89	89.3 Å²	89.3	42%	0.416	47%	0.47	S	S	.	.	H	α-helix	trans	-76.5	-31.4	178.4	-65.8	164	-163.3	0	0	110.7	C157 L158 V159 S164 E165	C157-E161 WeakPolarHBondContact CB-OE2 3.27Å; L158-E161 HydrophobicContact CB-CG 4.5Å; L158-E161 PolarHBondContact N-OE2 2.99Å; L158-E161 WeakPolarHBondContact O-CB 3.35Å; L158-E161 PolarHBondContact O-N 3.44Å; V159-E161 PolarHBondContact O-N 3.28Å; V159-E161 VanDerWaalsContact O-N 3.12Å; E161-S164 PolarHBondContact O-N 2.78Å; E161-S164 PolarHBondContact O-OG 3.37Å; E161-E165 PolarHBondContact O-N 3.34Å; E161-E165 VanDerWaalsContact O-N 3.15Å
162	L	90.6	Very high	88.7	Confident	0 Å²	0	93.1 Å²	93.1	0%	0	49%	0.49	C	S	.	.	H	α-helix	trans	-66.5	-39.4	171.8	-60.3	175.1	0	0	0	111.3	F148 L151 A152 V159 S164 E165 F166	F148-L162 HydrophobicContact CB-CD1 4.32Å; F148-L162 HydrophobicContact CD1-CB 4.43Å; F148-L162 HydrophobicContact CD1-CD1 4.15Å; F148-L162 WeakPolarHBondContact O-CD1 3.4Å; L151-L162 HydrophobicContact CB-CD1 4.05Å; L151-L162 HydrophobicContact CD2-CD1 4.07Å; L151-L162 HydrophobicContact CD2-CD2 4.07Å; L151-L162 HydrophobicContact CG-CD1 4.09Å; L151-L162 HydrophobicContact CG-CD2 4.28Å; A152-L162 HydrophobicContact CB-CD1 3.76Å; V159-L162 WeakPolarHBondContact O-CA 3.49Å; V159-L162 VanDerWaalsContact O-CB 3.3Å; V159-L162 WeakPolarHBondContact O-CB 3.42Å; V159-L162 PolarHBondContact O-N 3.2Å; L162-S164 VanDerWaalsContact C-N 3.31Å; L162-S164 PolarHBondContact O-N 3.43Å; L162-E165 WeakPolarHBondContact O-CB 3.38Å; L162-E165 PolarHBondContact O-N 3.47Å; L162-F166 HydrophobicContact CB-CD2 4.24Å; L162-F166 HydrophobicContact CB-CE2 4.27Å; L162-F166 HydrophobicContact CD2-CE2 4.37Å; L162-F166 WeakPolarHBondContact O-CD2 3.45Å; L162-F166 PolarHBondContact O-N 2.84Å
163	Y	91	Very high	88.4	Confident	39 Å²	39	97.5 Å²	97.5	15%	0.153	51%	0.512	C	S	.	.	H	α-helix	trans	-57.7	-45	176.8	-84.7	-108.3	0	0	0	111.3	F148 V159 E165 F166 D167 L168 L170	F148-Y163 AromaticContact CD2-CE2 3.89Å; F148-Y163 HydrophobicContact CD2-CE2 3.89Å; F148-Y163 HydrophobicContact CE2-CE2 4.22Å; V159-Y163 HydrophobicContact CG1-CD2 3.87Å; V159-Y163 HydrophobicContact CG1-CE2 3.5Å; V159-Y163 VanDerWaalsContact CG1-CE2 3.5Å; V159-Y163 WeakPolarHBondContact O-CD2 3.44Å; V159-Y163 PolarHBondContact O-N 3.27Å; Y163-E165 VanDerWaalsContact C-N 3.3Å; Y163-E165 PolarHBondContact O-N 2.65Å; Y163-F166 PolarHBondContact O-N 3.46Å; Y163-D167 PolarHBondContact O-N 3.39Å; Y163-L168 HydrophobicContact CD1-CB 3.64Å; Y163-L168 HydrophobicContact CD1-CD1 4.49Å; Y163-L168 HydrophobicContact CE1-CB 4.33Å; Y163-L168 HydrophobicContact CG-CB 4.24Å; Y163-L168 PolarHBondContact O-N 3.46Å; Y163-L170 HydrophobicContact CD1-CD1 3.96Å; Y163-L170 HydrophobicContact CD2-CD1 4.13Å; Y163-L170 HydrophobicContact CG-CD1 3.74Å
164	S	87.7	Confident	88.2	Confident	90 Å²	90	96.9 Å²	96.9	63%	0.629	51%	0.509	S	S	*	.	H	α-helix	trans	-66	-28.5	174.5	50.2	0	0	0	0	114.2	R160 E161 L162	R160-S164 PolarHBondContact O-N 2.81Å; E161-S164 PolarHBondContact O-N 2.78Å; E161-S164 PolarHBondContact O-OG 3.37Å; L162-S164 VanDerWaalsContact C-N 3.31Å; L162-S164 PolarHBondContact O-N 3.43Å
165	E	90.4	Very high	87.8	Confident	112 Å²	112	94.8 Å²	94.8	52%	0.523	50%	0.497	S	S	.	.	H	α-helix	trans	-75.8	-35	178.1	-172.4	-177.3	158.7	0	0	112.2	R155 E161 L162 Y163	R155-E165 IonicContact CZ-OE1 3.89Å; R155-E165 IonicContact CZ-OE2 2.76Å; R155-E165 IonicContact NH1-OE1 3.44Å; R155-E165 PolarHBondContact NH1-OE1 3.17Å; R155-E165 IonicContact NH1-OE2 3.96Å; R155-E165 PolarHBondContact NH1-OE2 2.93Å; R155-E165 IonicContact NH2-OE1 2.93Å; E161-E165 PolarHBondContact O-N 3.34Å; E161-E165 VanDerWaalsContact O-N 3.15Å; L162-E165 WeakPolarHBondContact O-CB 3.38Å; L162-E165 PolarHBondContact O-N 3.47Å; Y163-E165 VanDerWaalsContact C-N 3.3Å; Y163-E165 PolarHBondContact O-N 2.65Å
166	F	88.7	Confident	87.5	Confident	97 Å²	97	92.8 Å²	92.8	43%	0.425	50%	0.498	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.3	8.3	179.3	-68.2	-67.4	0	0	0	113.9	F148 L151 L162 Y163 L168	F148-F166 HydrophobicContact CD1-CE2 4.46Å; F148-F166 AromaticContact CE1-CD2 3.67Å; F148-F166 HydrophobicContact CE1-CD2 3.67Å; F148-F166 AromaticContact CE1-CE2 3.79Å; F148-F166 HydrophobicContact CE1-CE2 3.79Å; F148-F166 HydrophobicContact CZ-CD2 4.18Å; L151-F166 HydrophobicContact CD2-CE2 3.86Å; L151-F166 HydrophobicContact CD2-CZ 4.02Å; L162-F166 HydrophobicContact CB-CD2 4.24Å; L162-F166 HydrophobicContact CB-CE2 4.27Å; L162-F166 HydrophobicContact CD2-CE2 4.37Å; L162-F166 WeakPolarHBondContact O-CD2 3.45Å; L162-F166 PolarHBondContact O-N 2.84Å; Y163-F166 PolarHBondContact O-N 3.46Å; F166-L168 HydrophobicContact CB-CD1 3.91Å; F166-L168 HydrophobicContact CB-CG 3.97Å; F166-L168 PolarHBondContact O-N 3.25Å
167	D	89.3	Confident	87.1	Confident	155 Å²	155	94.1 Å²	94.1	83%	0.829	48%	0.482	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.6	37.7	-178.4	-134.3	6.9	0	0	0	112.4	Y163	Y163-D167 PolarHBondContact O-N 3.39Å
168	L	87.5	Confident	86.7	Confident	76 Å²	76	98.2 Å²	98.2	40%	0.398	50%	0.5	S	S	.	.			trans	-100.2	136	178.8	-65.8	172.8	0	0	0	110.8	F148 Y163 F166	F148-L168 HydrophobicContact CE2-CD1 3.7Å; F148-L168 HydrophobicContact CZ-CD1 3.47Å; F148-L168 VanDerWaalsContact CZ-CD1 3.47Å; Y163-L168 HydrophobicContact CD1-CB 3.64Å; Y163-L168 HydrophobicContact CD1-CD1 4.49Å; Y163-L168 HydrophobicContact CE1-CB 4.33Å; Y163-L168 HydrophobicContact CG-CB 4.24Å; Y163-L168 PolarHBondContact O-N 3.46Å; F166-L168 HydrophobicContact CB-CD1 3.91Å; F166-L168 HydrophobicContact CB-CG 3.97Å; F166-L168 PolarHBondContact O-N 3.25Å
169	N	84.2	Confident	86.4	Confident	106 Å²	106	98.8 Å²	98.8	57%	0.567	50%	0.502	S	S	*	.			trans	-79.8	138.1	172.5	-59.7	-49.7	0	0	0	110.3	D171 D172	N169-D171 PolarHBondContact O-N 3.33Å; N169-D172 PolarHBondContact ND2-OD2 2.54Å
170	L	78.8	Confident	86.1	Confident	112 Å²	112	102 Å²	102	59%	0.586	51%	0.514	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73	-17.3	176.5	-138	98	0	0	0	112.7	R160 Y163	R160-L170 HydrophobicContact CB-CD1 4.16Å; Y163-L170 HydrophobicContact CD1-CD1 3.96Å; Y163-L170 HydrophobicContact CD2-CD1 4.13Å; Y163-L170 HydrophobicContact CG-CD1 3.74Å
171	D	81.9	Confident	85.7	Confident	161 Å²	161	96.9 Å²	96.9	86%	0.861	51%	0.505	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.7	-3.6	-174.5	-63.9	-32.1	0	0	0	113.3	N169	N169-D171 PolarHBondContact O-N 3.33Å
172	D	68.7	Low	85.3	Confident	126 Å²	126	97.6 Å²	97.6	67%	0.674	51%	0.513	S	S	*	.			trans	-82.9	0	176.6	-74.9	-27.9	0	0	0	113	Y137 K141 N169	Y137-D172 PolarHBondContact OH-O 3.43Å; K141-D172 PolarHBondContact NZ-O 3.01Å; K141-D172 PolarHBondContact NZ-OXT 3.02Å; N169-D172 PolarHBondContact ND2-OD2 2.54Å

Retrieved 172 of 172 residues in 222 ms (Link to these results)

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