A0A077Z8T4_TRITR Loading...

BPTI-like C-terminal domain-containing protein

AlphaFold DB , UniProt , Accession A0A077Z8T4, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 168 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	35.1	Very low	38.6	Very low	243 Å²	243	160.1 Å²	160.1	100%	1.197	83%	0.829	S	S	*	*				0	83.8	0	-71.8	178.5	-86.9	0	0	108.4
2	V	38.4	Very low	38.9	Very low	142 Å²	142	164.3 Å²	164.3	86%	0.861	84%	0.837	S	S	*	*			trans	-147.4	87.3	164.8	-175.3	0	0	0	0	105.8
3	E	38.7	Very low	38.6	Very low	156 Å²	156	157.3 Å²	157.3	73%	0.729	83%	0.831	S	S	*	*			trans	-101.6	123	161.4	-79.6	176.1	122.7	0	0	106.2
4	V	40.3	Very low	38.6	Very low	138 Å²	138	155.6 Å²	155.6	84%	0.836	83%	0.829	S	S	*	*			trans	-137.5	104.8	161.6	-177.3	0	0	0	0	107
5	Y	40	Very low	38.7	Very low	191 Å²	191	153 Å²	153	75%	0.749	83%	0.828	S	S	*	*			trans	-75.9	144.2	179	-88.6	-98.9	0	0	0	111.9
6	L	37.2	Very low	38.6	Very low	162 Å²	162	150.6 Å²	150.6	85%	0.848	83%	0.827	S	S	*	*			trans	-7.6	120.3	148.8	-106.8	71.8	0	0	0	115.8
7	L	39.3	Very low	38.7	Very low	155 Å²	155	151.2 Å²	151.2	81%	0.812	83%	0.826	S	S	*	*			trans	-167.4	112.9	151.8	-101.4	145.6	0	0	0	106.8
8	F	39	Very low	38.5	Very low	198 Å²	198	148.6 Å²	148.6	87%	0.868	82%	0.821	S	S	*	*			trans	-175.4	96.6	135	-96.8	-67.4	0	0	0	108.4
9	A	35.7	Very low	38.2	Very low	87 Å²	87	148.4 Å²	148.4	72%	0.719	82%	0.818	S	S	*	*			trans	-82.5	123.9	163.2	0	0	0	0	0	108.8
10	L	43.8	Very low	38.5	Very low	148 Å²	148	146.5 Å²	146.5	78%	0.775	81%	0.813	S	S	*	*			trans	-146.4	92.4	163.9	-75.2	173.7	0	0	0	105.7
11	I	37.4	Very low	38.4	Very low	141 Å²	141	145.5 Å²	145.5	72%	0.723	81%	0.811	S	S	*	*				51.4	89.4	89.8	-47.6	170.8	0	0	0	113
12	F	41.9	Very low	38.8	Very low	210 Å²	210	139.9 Å²	139.9	92%	0.921	79%	0.79	S	S	*	*			trans	-161.2	126	138.1	-76.4	-71.8	0	0	0	103.9
13	G	35.5	Very low	38.7	Very low	74 Å²	74	139.9 Å²	139.9	76%	0.763	79%	0.785	S	S	*	*				123.8	114.7	59.7	0	0	0	0	0	106
14	V	38.6	Very low	38.6	Very low	133 Å²	133	140.2 Å²	140.2	81%	0.806	79%	0.79	S	S	*	*			trans	-66.3	134.4	-168.2	-176.9	0	0	0	0	111.6
15	S	39.9	Very low	38.5	Very low	117 Å²	117	144 Å²	144	82%	0.818	79%	0.789	S	S	*	*			trans	-159.8	114	150	-78.2	0	0	0	0	110.3	I17	S15-I17 PolarHBondContact O-N 3.48Å
16	S	35.8	Very low	38.2	Very low	115 Å²	115	143.4 Å²	143.4	80%	0.804	79%	0.794	S	S	*	*			trans	-65.9	119.1	-179.7	-38.1	0	0	0	0	110.8
17	I	40.3	Very low	38.3	Very low	160 Å²	160	140.5 Å²	140.5	82%	0.821	79%	0.793	S	S	*	*			trans	-121.4	113	156.7	-58.6	177.8	0	0	0	106.9	S15	S15-I17 PolarHBondContact O-N 3.48Å
18	S	36.4	Very low	38.2	Very low	105 Å²	105	141.1 Å²	141.1	73%	0.734	79%	0.791	S	S	*	*			trans	-59.4	140.5	177	39.2	0	0	0	0	112.3
19	L	32	Very low	38	Very low	144 Å²	144	139.8 Å²	139.8	75%	0.754	79%	0.788	S	S	*	*			trans	-44.6	145.3	172.1	-81.1	73.1	0	0	0	113.5	T21	L19-T21 HydrophobicContact CD2-CG2 3.84Å
20	P	43.9	Very low	38.3	Very low	111 Å²	111	141.7 Å²	141.7	72%	0.721	79%	0.793	S	S	*	*				-100	119.6	125.9	31.4	-24.8	0	0	0	108.8	V22	P20-V22 PolarHBondContact O-N 3.18Å
21	T	36.6	Very low	38.3	Very low	126 Å²	126	144.5 Å²	144.5	77%	0.773	79%	0.793	S	S	*	*			trans	-64	106.4	161.9	42.7	0	0	0	0	108.1	L19	L19-T21 HydrophobicContact CD2-CG2 3.84Å
22	V	44.4	Very low	38.5	Very low	125 Å²	125	143.6 Å²	143.6	76%	0.758	79%	0.794	S	S	*	*			trans	-99.1	116.2	166.8	172	0	0	0	0	107.4	P20 I24	P20-V22 PolarHBondContact O-N 3.18Å; V22-I24 PolarHBondContact O-N 3.41Å
23	D	36	Very low	38.8	Very low	142 Å²	142	139.2 Å²	139.2	76%	0.759	79%	0.785	S	S	*	*			trans	-47.5	124.6	-179.9	-107.6	-51.6	0	0	0	112.6	R25	D23-R25 VanDerWaalsContact C-N 3.33Å; D23-R25 PolarHBondContact O-N 3.05Å
24	I	36.9	Very low	39.5	Very low	162 Å²	162	139.7 Å²	139.7	83%	0.831	78%	0.781	S	S	*	*			trans	-76.3	89.5	166.9	-58.6	168	0	0	0	106.4	V22	V22-I24 PolarHBondContact O-N 3.41Å
25	R	37.1	Very low	40.2	Very low	218 Å²	218	136.7 Å²	136.7	82%	0.823	77%	0.766	S	S	*	*			trans	-102.4	86.3	160.1	-78	-169	171.7	-162.2	-1.6	109.1	D23 A27	D23-R25 VanDerWaalsContact C-N 3.33Å; D23-R25 PolarHBondContact O-N 3.05Å; R25-A27 VanDerWaalsContact C-N 3.34Å; R25-A27 PolarHBondContact O-N 3.07Å
26	E	34.3	Very low	40.8	Very low	179 Å²	179	135.7 Å²	135.7	84%	0.836	76%	0.755	S	S	*	*				20.1	66.2	129.9	-136	166.5	144.7	0	0	116.1	Q28	E26-Q28 PolarHBondContact O-N 2.88Å; E26-Q28 VanDerWaalsContact O-N 3.07Å
27	A	39.7	Very low	41.7	Very low	100 Å²	100	134.5 Å²	134.5	83%	0.826	74%	0.743	S	S	*	*			trans	-86	75.7	168.6	0	0	0	0	0	109.1	R25 Q29	R25-A27 VanDerWaalsContact C-N 3.34Å; R25-A27 PolarHBondContact O-N 3.07Å; A27-Q29 PolarHBondContact O-N 3.46Å
28	Q	36.1	Very low	41.9	Very low	168 Å²	168	132.4 Å²	132.4	79%	0.785	73%	0.733	S	S	*	*			trans	8	107.1	149.1	-149.6	137.8	-59.6	0	0	116.3	E26 P30	E26-Q28 PolarHBondContact O-N 2.88Å; E26-Q28 VanDerWaalsContact O-N 3.07Å; Q28-P30 VanDerWaalsContact O-CD 3.28Å; Q28-P30 WeakPolarHBondContact O-CD 3.22Å
29	Q	34.7	Very low	42.7	Very low	171 Å²	171	131.6 Å²	131.6	80%	0.799	72%	0.72	S	S	*	*			trans	-51.7	116.2	168.1	-169.7	167.1	0.4	0	0	111	A27 R31	A27-Q29 PolarHBondContact O-N 3.46Å; Q29-R31 PolarHBondContact O-N 2.91Å
30	P	43.2	Very low	43.6	Very low	127 Å²	127	127.2 Å²	127.2	83%	0.825	71%	0.705	S	S	*	*			trans	-72.3	103.7	172.5	-11.1	27.1	0	0	0	108.5	Q28 T32	Q28-P30 VanDerWaalsContact O-CD 3.28Å; Q28-P30 WeakPolarHBondContact O-CD 3.22Å; P30-T32 PolarHBondContact O-N 3.49Å
31	R	44.2	Very low	44	Very low	207 Å²	207	125.8 Å²	125.8	78%	0.781	69%	0.693	S	S	*	*			trans	-63.2	117	173.6	-68.4	178.6	177.3	171.6	-1	110.1	Q29 V33	Q29-R31 PolarHBondContact O-N 2.91Å; R31-V33 WeakPolarHBondContact O-CG2 3.28Å; R31-V33 PolarHBondContact O-N 3.35Å
32	T	40.4	Very low	44.6	Very low	121 Å²	121	124.7 Å²	124.7	74%	0.742	68%	0.682	S	S	*	*				49.8	33.3	129.4	58.3	0	0	0	0	119.9	P30	P30-T32 PolarHBondContact O-N 3.49Å
33	V	48.2	Very low	44.9	Very low	119 Å²	119	125.5 Å²	125.5	72%	0.721	68%	0.677	S	S	*	*	S	Bend	trans	-79.2	-21.5	173.7	-164.1	0	0	0	0	112.5	R31 S35 T36	R31-V33 WeakPolarHBondContact O-CG2 3.28Å; R31-V33 PolarHBondContact O-N 3.35Å; V33-S35 PolarHBondContact O-N 2.74Å; V33-T36 PolarHBondContact O-OG1 3.03Å
34	A	49.9	Very low	45.7	Very low	83 Å²	83	122.2 Å²	122.2	69%	0.686	67%	0.67	S	S	*	*	H	α-helix	trans	-76.8	-18.8	-173.9	0	0	0	0	0	115.1
35	S	54	Low	46.3	Very low	71 Å²	71	119.8 Å²	119.8	50%	0.497	66%	0.662	S	S	.	*	H	α-helix	trans	-83.5	-27.7	-171.7	-165	0	0	0	0	113.9	V33 I39	V33-S35 PolarHBondContact O-N 2.74Å; S35-I39 WeakPolarHBondContact O-CG1 3.45Å; S35-I39 PolarHBondContact O-N 3.34Å
36	T	53.4	Low	46.9	Very low	95 Å²	95	117.1 Å²	117.1	58%	0.583	66%	0.659	S	S	*	*	H	α-helix	trans	-73.2	-35	-176.3	34.6	0	0	0	0	112.3	V33 L38 I39 A40	V33-T36 PolarHBondContact O-OG1 3.03Å; T36-L38 VanDerWaalsContact C-N 3.34Å; T36-L38 PolarHBondContact O-N 2.66Å; T36-I39 PolarHBondContact O-N 2.91Å; T36-A40 WeakPolarHBondContact O-CB 3.35Å; T36-A40 PolarHBondContact O-N 3.14Å
37	T	53.1	Low	47.7	Very low	91 Å²	91	116.6 Å²	116.6	56%	0.558	65%	0.65	S	S	*	*	H	α-helix	trans	-66.9	-38.6	178.8	-23.9	0	0	0	0	111.3	A40 V41	T37-A40 PolarHBondContact O-N 3.25Å; T37-V41 WeakPolarHBondContact O-CB 3.17Å; T37-V41 WeakPolarHBondContact O-CG2 3.17Å; T37-V41 PolarHBondContact O-N 2.69Å
38	L	46.5	Very low	48.2	Very low	115 Å²	115	115.9 Å²	115.9	60%	0.602	63%	0.633	S	S	*	*	H	α-helix	trans	-65.7	-43.1	178.4	-113.9	149.3	0	0	0	111.8	T36 V41 I42	T36-L38 VanDerWaalsContact C-N 3.34Å; T36-L38 PolarHBondContact O-N 2.66Å; L38-V41 PolarHBondContact O-N 3.35Å; L38-I42 HydrophobicContact CD2-CD1 4.25Å; L38-I42 WeakPolarHBondContact O-CD1 3.38Å; L38-I42 WeakPolarHBondContact O-CG1 3.36Å; L38-I42 PolarHBondContact O-N 3.27Å
39	I	51.5	Low	48.9	Very low	88 Å²	88	109.6 Å²	109.6	45%	0.451	61%	0.61	S	S	.	*	H	α-helix	trans	-63.7	-44.3	176.1	-62.9	166.6	0	0	0	110.4	S35 T36 V41 I42 E43	S35-I39 WeakPolarHBondContact O-CG1 3.45Å; S35-I39 PolarHBondContact O-N 3.34Å; T36-I39 PolarHBondContact O-N 2.91Å; I39-V41 VanDerWaalsContact C-N 3.32Å; I39-V41 PolarHBondContact O-N 3.1Å; I39-I42 PolarHBondContact O-N 3.01Å; I39-E43 WeakPolarHBondContact O-CG 3.44Å; I39-E43 PolarHBondContact O-N 3.2Å
40	A	51.2	Low	49.6	Very low	53 Å²	53	103.5 Å²	103.5	44%	0.438	59%	0.588	S	S	.	*	H	α-helix	trans	-63.7	-35.3	177.3	0	0	0	0	0	113	T36 T37 A44	T36-A40 WeakPolarHBondContact O-CB 3.35Å; T36-A40 PolarHBondContact O-N 3.14Å; T37-A40 PolarHBondContact O-N 3.25Å; A40-A44 VanDerWaalsContact O-CB 3.3Å; A40-A44 WeakPolarHBondContact O-CB 3.42Å; A40-A44 PolarHBondContact O-N 2.95Å
41	V	51.8	Low	50.1	Low	80 Å²	80	102.6 Å²	102.6	49%	0.485	57%	0.573	S	S	.	*	H	α-helix	trans	-71.1	-37.8	175.2	176.2	0	0	0	0	110.9	T37 L38 I39 E43 A44 V45	T37-V41 WeakPolarHBondContact O-CB 3.17Å; T37-V41 WeakPolarHBondContact O-CG2 3.17Å; T37-V41 PolarHBondContact O-N 2.69Å; L38-V41 PolarHBondContact O-N 3.35Å; I39-V41 VanDerWaalsContact C-N 3.32Å; I39-V41 PolarHBondContact O-N 3.1Å; V41-E43 VanDerWaalsContact C-N 3.34Å; V41-A44 PolarHBondContact O-N 3.32Å; V41-V45 HydrophobicContact CG1-CG2 4.07Å; V41-V45 WeakPolarHBondContact O-CB 3.35Å; V41-V45 VanDerWaalsContact O-CG2 3.22Å; V41-V45 WeakPolarHBondContact O-CG2 3.27Å; V41-V45 PolarHBondContact O-N 3.49Å
42	I	49.1	Very low	50.7	Low	104 Å²	104	92.9 Å²	92.9	53%	0.533	54%	0.537	S	S	.	.	H	α-helix	trans	-65.8	-40.2	176.7	-63.3	159.2	0	0	0	110.4	L38 I39 V45 Q46	L38-I42 HydrophobicContact CD2-CD1 4.25Å; L38-I42 WeakPolarHBondContact O-CD1 3.38Å; L38-I42 WeakPolarHBondContact O-CG1 3.36Å; L38-I42 PolarHBondContact O-N 3.27Å; I39-I42 PolarHBondContact O-N 3.01Å; I42-V45 PolarHBondContact O-N 3.37Å; I42-Q46 PolarHBondContact O-N 3.43Å
43	E	52.3	Low	51.2	Low	142 Å²	142	90.5 Å²	90.5	66%	0.664	52%	0.519	S	S	*	.	H	α-helix	trans	-66.6	-36	173.8	-70.5	178.8	175.4	0	0	112.1	I39 V41	I39-E43 WeakPolarHBondContact O-CG 3.44Å; I39-E43 PolarHBondContact O-N 3.2Å; V41-E43 VanDerWaalsContact C-N 3.34Å
44	A	51.2	Low	51.3	Low	72 Å²	72	88.4 Å²	88.4	60%	0.595	50%	0.504	S	S	*	.	H	α-helix	trans	-74.2	-26.9	177.6	0	0	0	0	0	113.9	A40 V41	A40-A44 VanDerWaalsContact O-CB 3.3Å; A40-A44 WeakPolarHBondContact O-CB 3.42Å; A40-A44 PolarHBondContact O-N 2.95Å; V41-A44 PolarHBondContact O-N 3.32Å
45	V	50.5	Low	51.8	Low	111 Å²	111	90.3 Å²	90.3	67%	0.673	50%	0.502	S	S	*	.	H	α-helix	trans	-92.7	-8.1	-177.6	-179.4	0	0	0	0	112.7	V41 I42 Y47	V41-V45 HydrophobicContact CG1-CG2 4.07Å; V41-V45 WeakPolarHBondContact O-CB 3.35Å; V41-V45 VanDerWaalsContact O-CG2 3.22Å; V41-V45 WeakPolarHBondContact O-CG2 3.27Å; V41-V45 PolarHBondContact O-N 3.49Å; I42-V45 PolarHBondContact O-N 3.37Å; V45-Y47 PolarHBondContact O-N 3.46Å
46	Q	48.7	Very low	52.6	Low	162 Å²	162	94.1 Å²	94.1	76%	0.757	51%	0.512	S	S	*	.			trans	-71.2	58.1	155	-83.7	-172.8	-13.7	0	0	110.2	I42 D48	I42-Q46 PolarHBondContact O-N 3.43Å; Q46-D48 PolarHBondContact O-N 2.93Å
47	Y	51.2	Low	53.5	Low	168 Å²	168	92.4 Å²	92.4	66%	0.659	50%	0.503	S	S	*	.			trans	-70.6	80	163.5	-155.8	-92.5	0	0	0	106.4	V45 A49 S52	V45-Y47 PolarHBondContact O-N 3.46Å; Y47-A49 PolarHBondContact O-N 3.25Å; Y47-S52 WeakPolarHBondContact CE1-OG 3.22Å; Y47-S52 PolarHBondContact OH-OG 3.41Å
48	D	50.9	Low	54.3	Low	86 Å²	86	90.4 Å²	90.4	46%	0.46	49%	0.492	S	S	.	.			trans	-62.1	117.8	179.7	-170.7	-9.1	0	0	0	107.5	Q46 A50 Q51 S52	Q46-D48 PolarHBondContact O-N 2.93Å; D48-A50 VanDerWaalsContact CG-CB 3.46Å; D48-A50 CarbonylContact O-C 3.54Å; D48-A50 PolarHBondContact O-N 2.01Å; D48-A50 WeakPolarHBondContact OD1-CB 3.45Å; D48-A50 PolarHBondContact OD1-N 3.14Å; D48-Q51 HydrophobicContact CB-CB 4.29Å; D48-Q51 WeakPolarHBondContact O-CB 3.37Å; D48-Q51 PolarHBondContact O-N 3.2Å; D48-S52 PolarHBondContact O-N 2.82Å
49	A	50.8	Low	55.8	Low	36 Å²	36	94.1 Å²	94.1	30%	0.298	50%	0.503	S	S	.	.	H	α-helix	trans	-52	-28.3	172.5	0	0	0	0	0	110.6	Y47 S52 I53	Y47-A49 PolarHBondContact O-N 3.25Å; A49-S52 PolarHBondContact O-N 2.99Å; A49-I53 VanDerWaalsContact O-CG1 3.28Å; A49-I53 WeakPolarHBondContact O-CG1 3.09Å; A49-I53 PolarHBondContact O-N 3.08Å
50	A	49.6	Very low	57.2	Low	42 Å²	42	90.9 Å²	90.9	35%	0.347	49%	0.488	S	S	.	.	H	α-helix	trans	-59.2	-54	169.6	0	0	0	0	0	111.6	D48 S52 I53 L54	D48-A50 VanDerWaalsContact CG-CB 3.46Å; D48-A50 CarbonylContact O-C 3.54Å; D48-A50 PolarHBondContact O-N 2.01Å; D48-A50 WeakPolarHBondContact OD1-CB 3.45Å; D48-A50 PolarHBondContact OD1-N 3.14Å; A50-S52 PolarHBondContact O-N 2.91Å; A50-S52 VanDerWaalsContact O-N 3.16Å; A50-I53 CarbonylContact O-C 3.59Å; A50-I53 WeakPolarHBondContact O-CA 3.48Å; A50-I53 WeakPolarHBondContact O-CB 3.17Å; A50-I53 PolarHBondContact O-N 2.83Å; A50-L54 VanDerWaalsContact O-CG 3.29Å; A50-L54 WeakPolarHBondContact O-CG 3.46Å; A50-L54 PolarHBondContact O-N 2.82Å
51	Q	54.4	Low	58.9	Low	108 Å²	108	94.7 Å²	94.7	51%	0.505	50%	0.496	S	S	.	.	H	α-helix	trans	-55.6	-37.3	178.7	-128.2	66.7	-2	0	0	112.7	D48 L54 D55	D48-Q51 HydrophobicContact CB-CB 4.29Å; D48-Q51 WeakPolarHBondContact O-CB 3.37Å; D48-Q51 PolarHBondContact O-N 3.2Å; Q51-L54 HydrophobicContact CG-CD1 4.48Å; Q51-L54 CarbonylContact O-C 3.31Å; Q51-L54 VanDerWaalsContact O-CA 3.31Å; Q51-L54 WeakPolarHBondContact O-CA 2.96Å; Q51-L54 WeakPolarHBondContact O-CB 3.49Å; Q51-L54 PolarHBondContact O-N 3.25Å; Q51-D55 PolarHBondContact O-N 3.2Å
52	S	55.3	Low	60.7	Low	4 Å²	4	91.7 Å²	91.7	3%	0.028	48%	0.478	C	S	.	.	H	α-helix	trans	-76	-31.9	-179.3	-140.6	0	0	0	0	111.1	Y47 D48 A49 A50 D55 R96	Y47-S52 WeakPolarHBondContact CE1-OG 3.22Å; Y47-S52 PolarHBondContact OH-OG 3.41Å; D48-S52 PolarHBondContact O-N 2.82Å; A49-S52 PolarHBondContact O-N 2.99Å; A50-S52 PolarHBondContact O-N 2.91Å; A50-S52 VanDerWaalsContact O-N 3.16Å; S52-D55 PolarHBondContact O-N 3.04Å; S52-R96 VanDerWaalsContact C-CZ 3.47Å; S52-R96 PolarHBondContact O-NH1 3.2Å; S52-R96 PolarHBondContact OG-NH1 3.47Å; S52-R96 VanDerWaalsContact OG-NH1 3.08Å; S52-R96 PolarHBondContact OG-NH2 3.25Å
53	I	50.6	Low	62.8	Low	70 Å²	70	87.9 Å²	87.9	36%	0.359	46%	0.459	S	S	.	.	H	α-helix	trans	-64.3	-30.8	163.1	-66.1	162.9	0	0	0	111	A49 A50 E56	A49-I53 VanDerWaalsContact O-CG1 3.28Å; A49-I53 WeakPolarHBondContact O-CG1 3.09Å; A49-I53 PolarHBondContact O-N 3.08Å; A50-I53 CarbonylContact O-C 3.59Å; A50-I53 WeakPolarHBondContact O-CA 3.48Å; A50-I53 WeakPolarHBondContact O-CB 3.17Å; A50-I53 PolarHBondContact O-N 2.83Å; I53-E56 CarbonylContact O-C 3.52Å; I53-E56 VanDerWaalsContact O-O 3.13Å
54	L	51.8	Low	64.7	Low	76 Å²	76	81.6 Å²	81.6	40%	0.398	43%	0.432	S	S	.	.	H	α-helix	trans	-71.1	-31.3	175.3	-59.3	-179.8	0	0	0	113	A50 Q51 E56 N74	A50-L54 VanDerWaalsContact O-CG 3.29Å; A50-L54 WeakPolarHBondContact O-CG 3.46Å; A50-L54 PolarHBondContact O-N 2.82Å; Q51-L54 HydrophobicContact CG-CD1 4.48Å; Q51-L54 CarbonylContact O-C 3.31Å; Q51-L54 VanDerWaalsContact O-CA 3.31Å; Q51-L54 WeakPolarHBondContact O-CA 2.96Å; Q51-L54 WeakPolarHBondContact O-CB 3.49Å; Q51-L54 PolarHBondContact O-N 3.25Å; L54-E56 PolarHBondContact O-N 3.26Å; L54-N74 HydrophobicContact CD2-CB 3.62Å; L54-N74 WeakPolarHBondContact CD2-ND2 3.43Å
55	D	59.1	Low	66.6	Low	123 Å²	123	83.8 Å²	83.8	66%	0.658	43%	0.425	S	S	*	.	H	α-helix	trans	-67.2	-24.1	-178.7	-69.9	-26.7	0	0	0	112.7	Q51 S52	Q51-D55 PolarHBondContact O-N 3.2Å; S52-D55 PolarHBondContact O-N 3.04Å
56	E	71.2	Confident	68.6	Low	151 Å²	151	85.9 Å²	85.9	71%	0.706	43%	0.427	S	S	*	.	S	Bend	trans	-149	112.6	174.9	-166.8	178.8	-176.4	0	0	111.4	I53 L54	I53-E56 CarbonylContact O-C 3.52Å; I53-E56 VanDerWaalsContact O-O 3.13Å; L54-E56 PolarHBondContact O-N 3.26Å
57	C	71.9	Confident	70.7	Confident	59 Å²	59	79 Å²	79	40%	0.399	40%	0.397	S	S	.	.	P	Polyproline II helix	trans	-57.8	124.2	176.5	-62.3	0	0	0	0	110.7	K59 C76	C57-K59 PolarHBondContact O-N 2.78Å; C57-C76 WeakPolarHBondContact CA-SG 2.96Å; C57-C76 HydrophobicContact CB-CB 3.66Å; C57-C76 WeakPolarHBondContact CB-SG 3.42Å; C57-C76 WeakPolarHBondContact SG-CA 3.3Å; C57-C76 WeakPolarHBondContact SG-CB 3.16Å; C57-C76 CovalentContact SG-SG 2.04Å; C57-C76 PolarHBondContact SG-SG 2.71Å
58	P	71.5	Confident	72.6	Confident	49 Å²	49	75.2 Å²	75.2	32%	0.318	39%	0.391	S	S	.	.	P	Polyproline II helix	trans	-63.8	131.6	179.2	26.2	-33.2	0	0	0	109.9	V60 P94	P58-V60 PolarHBondContact O-N 3.44Å; P58-P94 HydrophobicContact CB-CB 4.24Å; P58-P94 HydrophobicContact CB-CG 4.22Å
59	K	77.7	Confident	74.6	Confident	192 Å²	192	74.9 Å²	74.9	84%	0.835	39%	0.388	S	S	*	.	P	Polyproline II helix	trans	-68.7	116.2	170.4	-64.4	-174.3	-178.7	-177.1	0	108.8	C57	C57-K59 PolarHBondContact O-N 2.78Å
60	V	79.7	Confident	76.5	Confident	21 Å²	21	75.9 Å²	75.9	13%	0.127	39%	0.39	C	S	.	.			trans	-122.9	141.2	175.1	-63.4	0	0	0	0	109.2	P58 M69 W154	P58-V60 PolarHBondContact O-N 3.44Å; V60-M69 HydrophobicContact CG2-CE 3.77Å; V60-M69 HydrophobicContact CG2-SD 3.89Å; V60-W154 HydrophobicContact CG1-CH2 4.4Å
61	H	87.4	Confident	78.2	Confident	132 Å²	132	81.1 Å²	81.1	61%	0.611	41%	0.405	S	S	*	.			trans	-100.1	-15.5	178.2	-58.2	-77.9	0	0	0	112.7	L63 D91	H61-L63 HydrophobicContact CB-CD1 4.24Å; H61-L63 HydrophobicContact CB-CD2 3.66Å; H61-L63 HydrophobicContact CB-CG 3.72Å; H61-D91 WeakPolarHBondContact CA-OD1 3.44Å; H61-D91 VanDerWaalsContact CB-OD1 3.26Å; H61-D91 WeakPolarHBondContact CB-OD1 3.33Å; H61-D91 IonicContact CD2-OD1 3.9Å; H61-D91 IonicContact CG-OD1 2.75Å; H61-D91 PolarHBondContact N-OD1 2.84Å
62	C	90	Very high	79.5	Confident	17 Å²	17	80.5 Å²	80.5	12%	0.115	40%	0.402	C	S	.	.			trans	56.9	54.8	178.5	-156.9	0	0	0	0	112.5	G64 C67 V68 M69 C79 D91	C62-G64 PolarHBondContact O-N 3.26Å; C62-C67 WeakPolarHBondContact SG-CB 3.44Å; C62-V68 VanDerWaalsContact SG-C 3.55Å; C62-M69 HydrophobicContact CB-CG 3.8Å; C62-M69 HydrophobicContact CB-SD 3.38Å; C62-M69 WeakPolarHBondContact CB-SD 3.49Å; C62-C79 WeakPolarHBondContact CA-SG 3.37Å; C62-C79 HydrophobicContact CB-CB 3.57Å; C62-C79 WeakPolarHBondContact CB-SG 3.01Å; C62-C79 VanDerWaalsContact SG-CA 3.53Å; C62-C79 WeakPolarHBondContact SG-CB 3.29Å; C62-C79 CovalentContact SG-SG 2.05Å; C62-C79 PolarHBondContact SG-SG 3.02Å; C62-D91 WeakPolarHBondContact CA-OD2 3.19Å; C62-D91 PolarHBondContact N-OD1 3.32Å; C62-D91 PolarHBondContact N-OD2 3.38Å
63	L	93	Very high	80.4	Confident	25 Å²	25	92.9 Å²	92.9	13%	0.131	45%	0.448	C	S	.	.			trans	-81.6	0.8	-172.2	-58	-179.1	0	0	0	114	H61 C90 D91 R127 I129 C167	H61-L63 HydrophobicContact CB-CD1 4.24Å; H61-L63 HydrophobicContact CB-CD2 3.66Å; H61-L63 HydrophobicContact CB-CG 3.72Å; L63-C90 HydrophobicContact CB-CB 4.2Å; L63-D91 PolarHBondContact N-OD2 2.92Å; L63-R127 HydrophobicContact CB-CB 4.42Å; L63-R127 HydrophobicContact CD1-CB 4.19Å; L63-R127 HydrophobicContact CD1-CG 4.26Å; L63-R127 WeakPolarHBondContact CD1-O 3.46Å; L63-I129 HydrophobicContact CD1-CD1 3.95Å; L63-I129 HydrophobicContact CD1-CG1 4.06Å; L63-I129 HydrophobicContact CD2-CD1 3.52Å; L63-I129 HydrophobicContact CD2-CG1 4.49Å; L63-I129 HydrophobicContact CG-CD1 4.32Å; L63-C167 CarbonylContact O-C 3.57Å
64	G	92.5	Very high	81.4	Confident	9 Å²	9	92.7 Å²	92.7	9%	0.093	45%	0.448	C	S	.	.	S	Bend	trans	-76.2	142.1	179.9	0	0	0	0	0	112.4	C62 E66 C67 A87	C62-G64 PolarHBondContact O-N 3.26Å; G64-E66 PolarHBondContact O-N 2.95Å; G64-C67 VanDerWaalsContact CA-SG 3.58Å; G64-C67 WeakPolarHBondContact O-CB 3.45Å; G64-C67 PolarHBondContact O-N 3.19Å; G64-C67 VanDerWaalsContact O-N 3.14Å; G64-A87 WeakPolarHBondContact CA-O 3.45Å
65	R	91.4	Very high	82.9	Confident	118 Å²	118	91.3 Å²	91.3	45%	0.445	45%	0.452	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.9	135.6	168.9	179.3	-176.4	-71.5	-154.7	0.8	109.3	C67 H165 Y166 Y168	R65-C67 PolarHBondContact O-N 3.38Å; R65-C67 VanDerWaalsContact O-N 3.07Å; R65-H165 PolarHBondContact NE-O 3.43Å; R65-Y166 VanDerWaalsContact CB-O 3.3Å; R65-Y166 WeakPolarHBondContact CB-O 3.35Å; R65-Y166 PolarHBondContact N-O 3Å; R65-Y168 PolarHBondContact NE-OXT 2.92Å; R65-Y168 PolarHBondContact NH2-OXT 2.99Å
66	E	91.3	Very high	83.9	Confident	155 Å²	155	85.8 Å²	85.8	72%	0.724	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.5	9.6	-177.9	-64.3	166	-180	0	0	114.7	G64 P82	G64-E66 PolarHBondContact O-N 2.95Å; E66-P82 HydrophobicContact CB-CG 3.91Å
67	C	92.6	Very high	84.6	Confident	19 Å²	19	83.4 Å²	83.4	13%	0.128	41%	0.412	C	S	.	.			trans	-83.2	150.7	171.4	-57.4	0	0	0	0	111.1	C62 G64 R65 C79 A80 C81 A87	C62-C67 WeakPolarHBondContact SG-CB 3.44Å; G64-C67 VanDerWaalsContact CA-SG 3.58Å; G64-C67 WeakPolarHBondContact O-CB 3.45Å; G64-C67 PolarHBondContact O-N 3.19Å; G64-C67 VanDerWaalsContact O-N 3.14Å; R65-C67 PolarHBondContact O-N 3.38Å; R65-C67 VanDerWaalsContact O-N 3.07Å; C67-C79 WeakPolarHBondContact CB-SG 3.28Å; C67-A80 CarbonylContact C-O 3.58Å; C67-A80 WeakPolarHBondContact CA-O 3.34Å; C67-C81 HydrophobicContact CB-CB 4.12Å; C67-C81 WeakPolarHBondContact CB-SG 3.19Å; C67-C81 WeakPolarHBondContact SG-CB 3.43Å; C67-C81 CovalentContact SG-SG 2.03Å; C67-C81 PolarHBondContact SG-SG 2.94Å; C67-A87 WeakPolarHBondContact SG-CB 3.43Å
68	V	92.2	Very high	85.3	Confident	87 Å²	87	81.6 Å²	81.6	53%	0.527	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	142.2	179.3	-65.6	0	0	0	0	110.5	C62 V70 A80	C62-V68 VanDerWaalsContact SG-C 3.55Å; V68-V70 HydrophobicContact CG2-CG1 3.99Å; V68-V70 PolarHBondContact O-N 2.91Å; V68-A80 HydrophobicContact CG2-CB 4.26Å; V68-A80 PolarHBondContact N-O 3.19Å; V68-A80 PolarHBondContact O-N 2.65Å
69	M	91.6	Very high	86	Confident	80 Å²	80	79.5 Å²	79.5	39%	0.394	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	126.5	171.9	-72.6	-65.3	-83	0	0	109.6	V60 C62 E77	V60-M69 HydrophobicContact CG2-CE 3.77Å; V60-M69 HydrophobicContact CG2-SD 3.89Å; C62-M69 HydrophobicContact CB-CG 3.8Å; C62-M69 HydrophobicContact CB-SD 3.38Å; C62-M69 WeakPolarHBondContact CB-SD 3.49Å; M69-E77 HydrophobicContact CE-CB 3.55Å; M69-E77 HydrophobicContact CE-CG 4.4Å
70	V	90.9	Very high	86.6	Confident	57 Å²	57	72.3 Å²	72.3	35%	0.345	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	156.2	176.9	-55.2	0	0	0	0	110	V68 E77 T78 A80	V68-V70 HydrophobicContact CG2-CG1 3.99Å; V68-V70 PolarHBondContact O-N 2.91Å; V70-E77 WeakPolarHBondContact O-CA 3.48Å; V70-T78 HydrophobicContact CG2-CG2 3.35Å; V70-T78 PolarHBondContact N-O 3.47Å; V70-T78 PolarHBondContact O-N 2.74Å; V70-A80 HydrophobicContact CG1-CB 3.87Å; V70-A80 HydrophobicContact CG2-CB 3.82Å
71	K	86.7	Confident	87.1	Confident	152 Å²	152	72.8 Å²	72.8	66%	0.661	37%	0.366	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100.4	124.3	174.5	-67.3	-174.2	179	-173.7	0	109.6	C76 E77	K71-C76 WeakPolarHBondContact CA-O 3.22Å; K71-E77 HydrophobicContact CG-CG 4.21Å
72	E	81.3	Confident	87.1	Confident	95 Å²	95	68.8 Å²	68.8	44%	0.444	35%	0.351	S	S	.	.			trans	-76.8	172.4	172.2	-78	-178.9	-170.8	0	0	111.2	N74 G75 C76 T78	E72-N74 VanDerWaalsContact CB-OD1 3.31Å; E72-N74 WeakPolarHBondContact CB-OD1 3.49Å; E72-N74 PolarHBondContact O-N 3.02Å; E72-N74 VanDerWaalsContact O-N 3.12Å; E72-G75 PolarHBondContact O-N 2.95Å; E72-C76 PolarHBondContact N-O 3.4Å; E72-T78 HydrophobicContact CG-CG2 3.6Å; E72-T78 WeakPolarHBondContact OE1-CG2 3.18Å; E72-T78 PolarHBondContact OE1-OG1 2.81Å
73	R	73.1	Confident	86.7	Confident	264 Å²	264	76.6 Å²	76.6	100%	0.996	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.2	-26.4	-177.4	-74.2	-173.6	178.2	-174.7	0.1	113.9	G75	R73-G75 PolarHBondContact O-N 3.08Å
74	N	73.3	Confident	86	Confident	66 Å²	66	79 Å²	79	35%	0.353	42%	0.421	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.4	-2.6	175.6	60.1	-0.9	0	0	0	113.4	L54 E72 C76	L54-N74 HydrophobicContact CD2-CB 3.62Å; L54-N74 WeakPolarHBondContact CD2-ND2 3.43Å; E72-N74 VanDerWaalsContact CB-OD1 3.31Å; E72-N74 WeakPolarHBondContact CB-OD1 3.49Å; E72-N74 PolarHBondContact O-N 3.02Å; E72-N74 VanDerWaalsContact O-N 3.12Å; N74-C76 VanDerWaalsContact C-N 3.25Å; N74-C76 PolarHBondContact O-N 2.78Å; N74-C76 WeakPolarHBondContact OD1-CB 3.48Å; N74-C76 PolarHBondContact OD1-N 2.93Å
75	G	81.6	Confident	85.6	Confident	47 Å²	47	79.3 Å²	79.3	49%	0.485	42%	0.422	S	S	.	.	S	Bend	trans	82.5	-5.3	-176.6	0	0	0	0	0	114.5	E72 R73	E72-G75 PolarHBondContact O-N 2.95Å; R73-G75 PolarHBondContact O-N 3.08Å
76	C	81.9	Confident	85.5	Confident	7 Å²	7	74.5 Å²	74.5	5%	0.047	41%	0.406	C	S	.	.			trans	-70.4	140.1	176.1	-67.3	0	0	0	0	111	C57 K71 E72 N74	C57-C76 WeakPolarHBondContact CA-SG 2.96Å; C57-C76 HydrophobicContact CB-CB 3.66Å; C57-C76 WeakPolarHBondContact CB-SG 3.42Å; C57-C76 WeakPolarHBondContact SG-CA 3.3Å; C57-C76 WeakPolarHBondContact SG-CB 3.16Å; C57-C76 CovalentContact SG-SG 2.04Å; C57-C76 PolarHBondContact SG-SG 2.71Å; K71-C76 WeakPolarHBondContact CA-O 3.22Å; E72-C76 PolarHBondContact N-O 3.4Å; N74-C76 VanDerWaalsContact C-N 3.25Å; N74-C76 PolarHBondContact O-N 2.78Å; N74-C76 WeakPolarHBondContact OD1-CB 3.48Å; N74-C76 PolarHBondContact OD1-N 2.93Å
77	E	85.8	Confident	85.4	Confident	101 Å²	101	67.1 Å²	67.1	47%	0.472	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	130.4	171.7	-58.8	-172.1	145.7	0	0	109.5	M69 V70 K71	M69-E77 HydrophobicContact CE-CB 3.55Å; M69-E77 HydrophobicContact CE-CG 4.4Å; V70-E77 WeakPolarHBondContact O-CA 3.48Å; K71-E77 HydrophobicContact CG-CG 4.21Å
78	T	85.2	Confident	85.2	Confident	21 Å²	21	69.6 Å²	69.6	13%	0.129	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	157.6	176.8	-165.7	0	0	0	0	108.7	V70 E72	V70-T78 HydrophobicContact CG2-CG2 3.35Å; V70-T78 PolarHBondContact N-O 3.47Å; V70-T78 PolarHBondContact O-N 2.74Å; E72-T78 HydrophobicContact CG-CG2 3.6Å; E72-T78 WeakPolarHBondContact OE1-CG2 3.18Å; E72-T78 PolarHBondContact OE1-OG1 2.81Å
79	C	87.7	Confident	85.1	Confident	5 Å²	5	65.4 Å²	65.4	3%	0.034	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	116.7	175.3	-173.7	0	0	0	0	109.9	C62 C67	C62-C79 WeakPolarHBondContact CA-SG 3.37Å; C62-C79 HydrophobicContact CB-CB 3.57Å; C62-C79 WeakPolarHBondContact CB-SG 3.01Å; C62-C79 VanDerWaalsContact SG-CA 3.53Å; C62-C79 WeakPolarHBondContact SG-CB 3.29Å; C62-C79 CovalentContact SG-SG 2.05Å; C62-C79 PolarHBondContact SG-SG 3.02Å; C67-C79 WeakPolarHBondContact CB-SG 3.28Å
80	A	88.9	Confident	85.2	Confident	41 Å²	41	61.6 Å²	61.6	34%	0.339	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	124.5	171.7	0	0	0	0	0	109.4	C67 V68 V70	C67-A80 CarbonylContact C-O 3.58Å; C67-A80 WeakPolarHBondContact CA-O 3.34Å; V68-A80 HydrophobicContact CG2-CB 4.26Å; V68-A80 PolarHBondContact N-O 3.19Å; V68-A80 PolarHBondContact O-N 2.65Å; V70-A80 HydrophobicContact CG1-CB 3.87Å; V70-A80 HydrophobicContact CG2-CB 3.82Å
81	C	90.1	Very high	85.2	Confident	30 Å²	30	59.2 Å²	59.2	20%	0.203	32%	0.319	C	S	.	.			trans	-126	162.4	-177.5	-63.9	0	0	0	0	110.5	C67 I83 A87 R88	C67-C81 HydrophobicContact CB-CB 4.12Å; C67-C81 WeakPolarHBondContact CB-SG 3.19Å; C67-C81 WeakPolarHBondContact SG-CB 3.43Å; C67-C81 CovalentContact SG-SG 2.03Å; C67-C81 PolarHBondContact SG-SG 2.94Å; C81-I83 PolarHBondContact O-N 3.41Å; C81-A87 HydrophobicContact CB-CB 4.41Å; C81-R88 HydrophobicContact CB-CB 4.16Å; C81-R88 WeakPolarHBondContact SG-CA 3.12Å
82	P	88.6	Confident	85.3	Confident	48 Å²	48	57 Å²	57	31%	0.312	31%	0.31	S	S	.	.			trans	-53.9	134.9	173	-25.1	33.9	0	0	0	112.1	E66 G84 S85	E66-P82 HydrophobicContact CB-CG 3.91Å; P82-G84 PolarHBondContact O-N 3.16Å; P82-S85 VanDerWaalsContact O-CB 3.23Å; P82-S85 WeakPolarHBondContact O-CB 2.97Å; P82-S85 PolarHBondContact O-N 2.99Å
83	I	81.3	Confident	85.7	Confident	181 Å²	181	52.7 Å²	52.7	93%	0.928	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	132.6	-178.4	-60.2	175	0	0	0	109.7	C81 S85	C81-I83 PolarHBondContact O-N 3.41Å; I83-S85 PolarHBondContact O-N 3.42Å
84	G	78.5	Confident	86.4	Confident	75 Å²	75	41.1 Å²	41.1	77%	0.773	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	77.4	-2.6	-178.9	0	0	0	0	0	114.8	P82	P82-G84 PolarHBondContact O-N 3.16Å
85	S	84.1	Confident	87.1	Confident	17 Å²	17	47 Å²	47	12%	0.119	27%	0.271	C	S	.	.			trans	-81	137.9	173.1	-178.8	0	0	0	0	111	P82 I83 A87 P155	P82-S85 VanDerWaalsContact O-CB 3.23Å; P82-S85 WeakPolarHBondContact O-CB 2.97Å; P82-S85 PolarHBondContact O-N 2.99Å; I83-S85 PolarHBondContact O-N 3.42Å; S85-A87 PolarHBondContact O-N 3.49Å; S85-A87 VanDerWaalsContact O-N 3.15Å; S85-A87 VanDerWaalsContact OG-CB 3.24Å; S85-A87 WeakPolarHBondContact OG-CB 3.38Å; S85-A87 PolarHBondContact OG-N 2.79Å; S85-P155 WeakPolarHBondContact O-CG 3.32Å
86	P	88.2	Confident	87.3	Confident	17 Å²	17	49.8 Å²	49.8	11%	0.11	27%	0.267	C	S	.	.	G	3₁₀ helix	trans	-74.2	6.9	170.6	35	-37.1	0	0	0	113	R88 G89 P155 P157 Y166	P86-R88 PolarHBondContact O-N 2.84Å; P86-G89 PolarHBondContact O-N 3.41Å; P86-P155 CarbonylContact C-O 3.49Å; P86-P155 VanDerWaalsContact C-O 3.31Å; P86-P155 VanDerWaalsContact CA-O 3.23Å; P86-P155 WeakPolarHBondContact CA-O 3.31Å; P86-P157 HydrophobicContact CB-CG 4.29Å; P86-P157 WeakPolarHBondContact O-CD 3Å; P86-Y166 HydrophobicContact CG-CD1 4Å; P86-Y166 HydrophobicContact CG-CD2 3.27Å; P86-Y166 HydrophobicContact CG-CE1 4.17Å; P86-Y166 HydrophobicContact CG-CE2 3.48Å; P86-Y166 VanDerWaalsContact CG-CE2 3.48Å; P86-Y166 HydrophobicContact CG-CG 3.56Å
87	A	90.1	Very high	87.5	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	27%	0.273	C	S	.	.	G	3₁₀ helix	trans	-60	-26.9	178.8	0	0	0	0	0	112.9	G64 C67 C81 S85 G89 C90	G64-A87 WeakPolarHBondContact CA-O 3.45Å; C67-A87 WeakPolarHBondContact SG-CB 3.43Å; C81-A87 HydrophobicContact CB-CB 4.41Å; S85-A87 PolarHBondContact O-N 3.49Å; S85-A87 VanDerWaalsContact O-N 3.15Å; S85-A87 VanDerWaalsContact OG-CB 3.24Å; S85-A87 WeakPolarHBondContact OG-CB 3.38Å; S85-A87 PolarHBondContact OG-N 2.79Å; A87-G89 VanDerWaalsContact C-N 3.34Å; A87-G89 PolarHBondContact O-N 2.9Å; A87-C90 WeakPolarHBondContact O-CB 3.2Å; A87-C90 PolarHBondContact O-N 3.04Å; A87-C90 PolarHBondContact O-SG 3.18Å
88	R	87.2	Confident	87.6	Confident	70 Å²	70	48 Å²	48	26%	0.264	26%	0.259	S	S	.	.	G	3₁₀ helix	trans	-66.7	-34.1	177.3	-166.2	172.4	-169.8	-179.2	6.8	112.9	C81 P86 C90 V153 P155	C81-R88 HydrophobicContact CB-CB 4.16Å; C81-R88 WeakPolarHBondContact SG-CA 3.12Å; P86-R88 PolarHBondContact O-N 2.84Å; R88-C90 VanDerWaalsContact C-N 3.25Å; R88-C90 PolarHBondContact O-N 3.18Å; R88-V153 WeakPolarHBondContact CD-O 3.41Å; R88-V153 PolarHBondContact NH1-O 3.13Å; R88-P155 HydrophobicContact CB-CG 4.03Å
89	G	90.8	Very high	87.8	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	29%	0.285	C	S	.	.	G	3₁₀ helix	trans	-88.2	16	175.9	0	0	0	0	0	114.2	P86 A87 D91 P155	P86-G89 PolarHBondContact O-N 3.41Å; A87-G89 VanDerWaalsContact C-N 3.34Å; A87-G89 PolarHBondContact O-N 2.9Å; G89-D91 CarbonylContact C-O 3.46Å; G89-P155 VanDerWaalsContact CA-O 3.23Å; G89-P155 WeakPolarHBondContact CA-O 3.11Å; G89-P155 PolarHBondContact N-O 3.24Å
90	C	94.3	Very high	87.9	Confident	0 Å²	0	55.9 Å²	55.9	0%	0	29%	0.292	C	S	.	.	G	3₁₀ helix	trans	-66.8	-27.4	165.9	-71.1	0	0	0	0	112.1	L63 A87 R88 Y126 R127 Y166 C167	L63-C90 HydrophobicContact CB-CB 4.2Å; A87-C90 WeakPolarHBondContact O-CB 3.2Å; A87-C90 PolarHBondContact O-N 3.04Å; A87-C90 PolarHBondContact O-SG 3.18Å; R88-C90 VanDerWaalsContact C-N 3.25Å; R88-C90 PolarHBondContact O-N 3.18Å; C90-Y126 WeakPolarHBondContact O-CB 3.11Å; C90-R127 PolarHBondContact O-N 2.03Å; C90-Y166 PolarHBondContact SG-O 2.87Å; C90-C167 WeakPolarHBondContact CA-SG 3.41Å; C90-C167 HydrophobicContact CB-CB 3.62Å; C90-C167 WeakPolarHBondContact CB-SG 3.35Å; C90-C167 WeakPolarHBondContact SG-CA 3.28Å; C90-C167 WeakPolarHBondContact SG-CB 3.45Å; C90-C167 CovalentContact SG-SG 2.03Å; C90-C167 PolarHBondContact SG-SG 2.69Å
91	D	90.5	Very high	88	Confident	7 Å²	7	54 Å²	54	4%	0.037	28%	0.276	C	S	.	.	S	Bend	trans	-77.8	146.5	163.4	-73.9	-84.9	0	0	0	110.7	H61 C62 L63 G89 M93 W154	H61-D91 WeakPolarHBondContact CA-OD1 3.44Å; H61-D91 VanDerWaalsContact CB-OD1 3.26Å; H61-D91 WeakPolarHBondContact CB-OD1 3.33Å; H61-D91 IonicContact CD2-OD1 3.9Å; H61-D91 IonicContact CG-OD1 2.75Å; H61-D91 PolarHBondContact N-OD1 2.84Å; C62-D91 WeakPolarHBondContact CA-OD2 3.19Å; C62-D91 PolarHBondContact N-OD1 3.32Å; C62-D91 PolarHBondContact N-OD2 3.38Å; L63-D91 PolarHBondContact N-OD2 2.92Å; G89-D91 CarbonylContact C-O 3.46Å; D91-M93 PolarHBondContact O-N 2.88Å; D91-W154 HydrophobicContact CB-CH2 4.26Å; D91-W154 HydrophobicContact CB-CZ2 3.74Å; D91-W154 WeakPolarHBondContact O-CZ2 3.05Å; D91-W154 PolarHBondContact O-NE1 2.63Å; D91-W154 VanDerWaalsContact O-NE1 3.16Å
92	K	89.7	Confident	88	Confident	105 Å²	105	56.7 Å²	56.7	46%	0.457	29%	0.285	S	S	.	.	P	Polyproline II helix	trans	-63.4	135.3	168.9	-166.1	175.9	-178.1	172.2	0	108.8	Y126 Y141	K92-Y126 HydrophobicContact CB-CD2 3.84Å; K92-Y126 HydrophobicContact CB-CE2 4.01Å; K92-Y126 HydrophobicContact CB-CG 4.25Å; K92-Y126 HydrophobicContact CD-CE2 4.44Å; K92-Y141 HydrophobicContact CG-CD2 4.1Å; K92-Y141 HydrophobicContact CG-CE2 3.89Å
93	M	89.4	Confident	88.1	Confident	4 Å²	4	59.1 Å²	59.1	2%	0.02	30%	0.299	C	S	.	.	P	Polyproline II helix	trans	-49.3	133.2	175.6	-178.2	178.8	-78.2	0	0	110.6	D91 K95 M97 L98 L101 Y141 F143 P144 W154	D91-M93 PolarHBondContact O-N 2.88Å; M93-K95 PolarHBondContact O-N 3.1Å; M93-M97 HydrophobicContact CE-CG 4.48Å; M93-M97 HydrophobicContact CE-SD 3.99Å; M93-M97 HydrophobicContact CG-CB 4.07Å; M93-M97 HydrophobicContact CG-CG 4.04Å; M93-M97 HydrophobicContact CG-SD 3.86Å; M93-M97 HydrophobicContact SD-CB 4.32Å; M93-M97 HydrophobicContact SD-CG 3.85Å; M93-M97 HydrophobicContact SD-SD 4.01Å; M93-L98 HydrophobicContact CB-CD1 4.23Å; M93-L98 HydrophobicContact CG-CB 4.26Å; M93-L98 HydrophobicContact CG-CD1 4.43Å; M93-L98 HydrophobicContact SD-CB 4.14Å; M93-L98 HydrophobicContact SD-CD1 3.94Å; M93-L101 HydrophobicContact CE-CD1 4.06Å; M93-L101 HydrophobicContact SD-CD1 3.98Å; M93-Y141 HydrophobicContact CB-CE2 4.42Å; M93-Y141 PolarHBondContact N-OH 3.32Å; M93-F143 HydrophobicContact CE-CD2 4.34Å; M93-F143 HydrophobicContact CE-CE1 4.4Å; M93-F143 HydrophobicContact CE-CE2 3.54Å; M93-F143 HydrophobicContact CE-CZ 3.57Å; M93-P144 HydrophobicContact SD-CG 3.93Å; M93-W154 HydrophobicContact CE-CB 3.88Å; M93-W154 HydrophobicContact CE-CG 4.01Å
94	P	87.2	Confident	88.6	Confident	22 Å²	22	55 Å²	55	14%	0.143	28%	0.278	C	S	.	.	P	Polyproline II helix	trans	-53.9	135.2	-179.9	-28	35.6	0	0	0	110.6	P58 R96 M97 L98 W154	P58-P94 HydrophobicContact CB-CB 4.24Å; P58-P94 HydrophobicContact CB-CG 4.22Å; P94-R96 PolarHBondContact O-N 3.42Å; P94-M97 PolarHBondContact O-N 3.09Å; P94-L98 PolarHBondContact O-N 3.4Å; P94-W154 VanDerWaalsContact CD-CH2 3.49Å; P94-W154 HydrophobicContact CG-CH2 3.9Å; P94-W154 HydrophobicContact CG-CZ3 3.99Å
95	K	87.4	Confident	89.2	Confident	188 Å²	188	51.6 Å²	51.6	82%	0.817	24%	0.244	S	C	*	.	H	α-helix	trans	-51.5	-37.3	-173.9	-70.2	-177.9	-179.5	176.8	0	112.9	M93 K99	M93-K95 PolarHBondContact O-N 3.1Å; K95-K99 WeakPolarHBondContact O-CB 3.45Å; K95-K99 PolarHBondContact O-N 2.88Å
96	R	85.4	Confident	89.5	Confident	107 Å²	107	50.8 Å²	50.8	40%	0.404	24%	0.238	S	C	.	.	H	α-helix	trans	-62.4	-56.4	178	-173.9	-166.9	174.1	102.3	34.4	111.7	S52 P94 L98 K99 E100	S52-R96 VanDerWaalsContact C-CZ 3.47Å; S52-R96 PolarHBondContact O-NH1 3.2Å; S52-R96 PolarHBondContact OG-NH1 3.47Å; S52-R96 VanDerWaalsContact OG-NH1 3.08Å; S52-R96 PolarHBondContact OG-NH2 3.25Å; P94-R96 PolarHBondContact O-N 3.42Å; R96-L98 VanDerWaalsContact C-N 3.29Å; R96-L98 PolarHBondContact O-N 3.26Å; R96-K99 PolarHBondContact O-N 3.43Å; R96-E100 WeakPolarHBondContact O-CB 3.23Å; R96-E100 PolarHBondContact O-N 2.89Å
97	M	86.6	Confident	89.5	Confident	36 Å²	36	52.4 Å²	52.4	18%	0.177	24%	0.244	C	C	.	.	H	α-helix	trans	-58.7	-43.9	177.8	-177.5	-175.2	-67.6	0	0	110.9	M93 P94 K99 E100 L101 V153	M93-M97 HydrophobicContact CE-CG 4.48Å; M93-M97 HydrophobicContact CE-SD 3.99Å; M93-M97 HydrophobicContact CG-CB 4.07Å; M93-M97 HydrophobicContact CG-CG 4.04Å; M93-M97 HydrophobicContact CG-SD 3.86Å; M93-M97 HydrophobicContact SD-CB 4.32Å; M93-M97 HydrophobicContact SD-CG 3.85Å; M93-M97 HydrophobicContact SD-SD 4.01Å; P94-M97 PolarHBondContact O-N 3.09Å; M97-K99 PolarHBondContact O-N 3.32Å; M97-E100 PolarHBondContact O-N 2.95Å; M97-L101 HydrophobicContact CG-CD1 4.01Å; M97-L101 HydrophobicContact CG-CG 4.41Å; M97-L101 WeakPolarHBondContact O-CG 3.33Å; M97-L101 PolarHBondContact O-N 3.42Å; M97-V153 HydrophobicContact CE-CG1 3.82Å; M97-V153 HydrophobicContact SD-CG1 4.21Å
98	L	88.9	Confident	89.2	Confident	34 Å²	34	54.8 Å²	54.8	18%	0.178	26%	0.257	C	S	.	.	H	α-helix	trans	-55.6	-50.2	175.8	-169.8	81.9	0	0	0	111.2	M93 P94 R96 F102 Y141 P144	M93-L98 HydrophobicContact CB-CD1 4.23Å; M93-L98 HydrophobicContact CG-CB 4.26Å; M93-L98 HydrophobicContact CG-CD1 4.43Å; M93-L98 HydrophobicContact SD-CB 4.14Å; M93-L98 HydrophobicContact SD-CD1 3.94Å; P94-L98 PolarHBondContact O-N 3.4Å; R96-L98 VanDerWaalsContact C-N 3.29Å; R96-L98 PolarHBondContact O-N 3.26Å; L98-F102 HydrophobicContact CD1-CD2 4.38Å; L98-F102 HydrophobicContact CD1-CE2 3.85Å; L98-F102 HydrophobicContact CG-CD2 4.03Å; L98-F102 HydrophobicContact CG-CE2 3.92Å; L98-F102 WeakPolarHBondContact O-CD2 3.24Å; L98-F102 PolarHBondContact O-N 3.17Å; L98-F102 VanDerWaalsContact O-N 3.16Å; L98-Y141 HydrophobicContact CD1-CE2 4.46Å; L98-P144 VanDerWaalsContact CD1-CD 3.44Å; L98-P144 HydrophobicContact CD1-CG 3.9Å
99	K	89.2	Confident	88.9	Confident	152 Å²	152	55.2 Å²	55.2	66%	0.661	26%	0.264	S	S	*	.	H	α-helix	trans	-63.8	-44.1	179.7	-178	-179.1	177.5	-175.4	0	112	K95 R96 M97 F102 T103	K95-K99 WeakPolarHBondContact O-CB 3.45Å; K95-K99 PolarHBondContact O-N 2.88Å; R96-K99 PolarHBondContact O-N 3.43Å; M97-K99 PolarHBondContact O-N 3.32Å; K99-F102 PolarHBondContact O-N 3.4Å; K99-T103 VanDerWaalsContact O-CB 3.29Å; K99-T103 WeakPolarHBondContact O-CB 3.23Å; K99-T103 PolarHBondContact O-N 3.04Å; K99-T103 PolarHBondContact O-OG1 3.16Å
100	E	89.4	Confident	88.5	Confident	40 Å²	40	63.5 Å²	63.5	19%	0.187	30%	0.3	C	S	.	.	H	α-helix	trans	-60.2	-49.8	-179.8	-176.3	173.6	174.6	0	0	111.4	R96 M97 F102 T103 N104	R96-E100 WeakPolarHBondContact O-CB 3.23Å; R96-E100 PolarHBondContact O-N 2.89Å; M97-E100 PolarHBondContact O-N 2.95Å; E100-F102 VanDerWaalsContact C-N 3.35Å; E100-F102 PolarHBondContact O-N 2.92Å; E100-T103 PolarHBondContact O-N 2.88Å; E100-N104 WeakPolarHBondContact O-CB 3.35Å; E100-N104 PolarHBondContact O-N 3.06Å
101	L	91.1	Very high	88.1	Confident	2 Å²	2	66.4 Å²	66.4	1%	0.01	32%	0.32	C	S	.	.	H	α-helix	trans	-65.9	-35.3	-180	-65.1	176.9	0	0	0	112.8	M93 M97 G105 A119 P144 Y149	M93-L101 HydrophobicContact CE-CD1 4.06Å; M93-L101 HydrophobicContact SD-CD1 3.98Å; M97-L101 HydrophobicContact CG-CD1 4.01Å; M97-L101 HydrophobicContact CG-CG 4.41Å; M97-L101 WeakPolarHBondContact O-CG 3.33Å; M97-L101 PolarHBondContact O-N 3.42Å; L101-G105 WeakPolarHBondContact O-CA 3.28Å; L101-G105 PolarHBondContact O-N 2.69Å; L101-G105 VanDerWaalsContact O-N 3.14Å; L101-A119 WeakPolarHBondContact O-CB 3Å; L101-P144 HydrophobicContact CB-CB 3.79Å; L101-P144 HydrophobicContact CB-CG 3.81Å; L101-P144 HydrophobicContact CD1-CG 4.04Å; L101-Y149 HydrophobicContact CD1-CD1 4.06Å; L101-Y149 HydrophobicContact CD1-CE1 4.46Å; L101-Y149 HydrophobicContact CD1-CG 4.36Å; L101-Y149 HydrophobicContact CD2-CD1 4.2Å; L101-Y149 HydrophobicContact CD2-CD2 4.34Å; L101-Y149 HydrophobicContact CD2-CE1 3.94Å; L101-Y149 HydrophobicContact CD2-CE2 4.1Å; L101-Y149 HydrophobicContact CD2-CG 4.39Å
102	F	90.7	Very high	87.5	Confident	86 Å²	86	70.5 Å²	70.5	38%	0.377	35%	0.347	S	S	.	.	H	α-helix	trans	-72.2	-32.2	173.9	-83.1	-58.5	0	0	0	113.6	L98 K99 E100 P121 L142 P144	L98-F102 HydrophobicContact CD1-CD2 4.38Å; L98-F102 HydrophobicContact CD1-CE2 3.85Å; L98-F102 HydrophobicContact CG-CD2 4.03Å; L98-F102 HydrophobicContact CG-CE2 3.92Å; L98-F102 WeakPolarHBondContact O-CD2 3.24Å; L98-F102 PolarHBondContact O-N 3.17Å; L98-F102 VanDerWaalsContact O-N 3.16Å; K99-F102 PolarHBondContact O-N 3.4Å; E100-F102 VanDerWaalsContact C-N 3.35Å; E100-F102 PolarHBondContact O-N 2.92Å; F102-P121 HydrophobicContact CE1-CB 4.41Å; F102-L142 HydrophobicContact CE1-CD2 4.22Å; F102-L142 HydrophobicContact CZ-CD2 3.86Å; F102-L142 HydrophobicContact CZ-CG 3.94Å; F102-P144 HydrophobicContact CD1-CB 3.98Å; F102-P144 HydrophobicContact CD2-CB 4.03Å; F102-P144 HydrophobicContact CD2-CG 4.12Å; F102-P144 HydrophobicContact CE1-CB 3.8Å; F102-P144 HydrophobicContact CE2-CB 3.87Å; F102-P144 HydrophobicContact CE2-CG 3.86Å; F102-P144 HydrophobicContact CG-CB 4.07Å; F102-P144 HydrophobicContact CZ-CB 3.73Å; F102-P144 HydrophobicContact CZ-CG 4.14Å
103	T	90.6	Very high	87.2	Confident	99 Å²	99	73.4 Å²	73.4	61%	0.607	37%	0.368	S	S	*	.	H	α-helix	trans	-88.2	-48	-173.7	-52	0	0	0	0	111.8	K99 E100	K99-T103 VanDerWaalsContact O-CB 3.29Å; K99-T103 WeakPolarHBondContact O-CB 3.23Å; K99-T103 PolarHBondContact O-N 3.04Å; K99-T103 PolarHBondContact O-OG1 3.16Å; E100-T103 PolarHBondContact O-N 2.88Å
104	N	90.5	Very high	87	Confident	93 Å²	93	75.2 Å²	75.2	50%	0.497	38%	0.381	S	S	.	.	H	α-helix	trans	-97.5	-21.9	-173.8	-61.4	-22.2	0	0	0	111.8	E100 L116	E100-N104 WeakPolarHBondContact O-CB 3.35Å; E100-N104 PolarHBondContact O-N 3.06Å; N104-L116 HydrophobicContact CB-CD2 4.1Å; N104-L116 WeakPolarHBondContact O-CD2 3.37Å
105	G	91.5	Very high	87.1	Confident	5 Å²	5	83.4 Å²	83.4	5%	0.052	41%	0.414	C	S	.	.			trans	91.1	-166.5	-174.1	0	0	0	0	0	112.7	L101 Y117	L101-G105 WeakPolarHBondContact O-CA 3.28Å; L101-G105 PolarHBondContact O-N 2.69Å; L101-G105 VanDerWaalsContact O-N 3.14Å; G105-Y117 CarbonylContact C-O 3.54Å; G105-Y117 WeakPolarHBondContact CA-O 3.46Å
106	C	91.2	Very high	87.1	Confident	0 Å²	0	77.9 Å²	77.9	0%	0	39%	0.393	C	S	.	.	B	Isolated β-bridge	trans	-91	136.6	-177.1	-53.2	0	0	0	0	111.2	L116 Y117 A119 C146	C106-L116 WeakPolarHBondContact O-CA 3.24Å; C106-Y117 HydrophobicContact CB-CD1 4.09Å; C106-Y117 HydrophobicContact CB-CD2 3.67Å; C106-Y117 HydrophobicContact CB-CE1 3.69Å; C106-Y117 HydrophobicContact CB-CE2 3.23Å; C106-Y117 HydrophobicContact CB-CG 4.08Å; C106-Y117 PolarHBondContact N-O 3.16Å; C106-Y117 PolarHBondContact O-N 3.42Å; C106-Y117 WeakPolarHBondContact SG-CE2 3.36Å; C106-A119 WeakPolarHBondContact SG-CA 3Å; C106-C146 VanDerWaalsContact CA-SG 3.55Å; C106-C146 HydrophobicContact CB-CB 3.57Å; C106-C146 WeakPolarHBondContact CB-SG 3.06Å; C106-C146 WeakPolarHBondContact SG-CA 3.38Å; C106-C146 WeakPolarHBondContact SG-CB 3.2Å; C106-C146 CovalentContact SG-SG 2.01Å; C106-C146 PolarHBondContact SG-SG 2.63Å
107	H	87.1	Confident	87.3	Confident	51 Å²	51	76.7 Å²	76.7	24%	0.236	39%	0.389	C	S	.	.			trans	-92.9	144.3	165.6	-66.3	-93.3	0	0	0	110.2	L109 L116 Y149	H107-L109 PolarHBondContact O-N 3.45Å; H107-L116 VanDerWaalsContact CE1-CD2 3.44Å; H107-L116 WeakPolarHBondContact CE1-CD2 3.27Å; H107-L116 WeakPolarHBondContact NE2-CD2 3.46Å; H107-Y149 HydrophobicContact CB-CE2 4.45Å
108	N	84.2	Confident	87.6	Confident	50 Å²	50	80.1 Å²	80.1	27%	0.267	41%	0.414	S	S	.	.			trans	-76.8	111.5	164.3	-174	-41.7	0	0	0	108.2	K110 S111 S114	N108-K110 PolarHBondContact O-N 3.08Å; N108-K110 WeakPolarHBondContact OD1-CA 3.23Å; N108-K110 WeakPolarHBondContact OD1-CB 3.29Å; N108-K110 PolarHBondContact OD1-N 3.18Å; N108-S111 CarbonylContact O-C 3.55Å; N108-S111 PolarHBondContact O-N 3.31Å; N108-S111 PolarHBondContact OD1-N 3.17Å; N108-S111 VanDerWaalsContact OD1-N 3.14Å; N108-S114 WeakPolarHBondContact CB-OG 3.31Å
109	L	80.5	Confident	87.8	Confident	78 Å²	78	79.3 Å²	79.3	41%	0.408	41%	0.412	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-22.4	-175.9	-63.9	-178.5	0	0	0	112.4	H107 D148 Y149 V153	H107-L109 PolarHBondContact O-N 3.45Å; L109-D148 HydrophobicContact CB-CB 4.26Å; L109-D148 HydrophobicContact CD1-CB 3.94Å; L109-D148 HydrophobicContact CG-CB 3.9Å; L109-D148 PolarHBondContact N-OD2 2.87Å; L109-Y149 HydrophobicContact CD1-CD2 4.4Å; L109-Y149 HydrophobicContact CD1-CE2 4.45Å; L109-Y149 HydrophobicContact CD2-CD2 4.47Å; L109-Y149 HydrophobicContact CD2-CE2 3.74Å; L109-Y149 HydrophobicContact CG-CD2 4.4Å; L109-Y149 HydrophobicContact CG-CE2 4.08Å; L109-V153 HydrophobicContact CD1-CG2 3.6Å
110	K	84.1	Confident	88.1	Confident	175 Å²	175	75.8 Å²	75.8	76%	0.761	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.8	-15.3	175.4	-57.4	-179.3	-179.7	176	0	112.9	N108	N108-K110 PolarHBondContact O-N 3.08Å; N108-K110 WeakPolarHBondContact OD1-CA 3.23Å; N108-K110 WeakPolarHBondContact OD1-CB 3.29Å; N108-K110 PolarHBondContact OD1-N 3.18Å
111	S	85.7	Confident	88.3	Confident	61 Å²	61	77.7 Å²	77.7	43%	0.427	42%	0.419	S	S	.	.			trans	-145.4	76.1	-175.2	-66.1	0	0	0	0	109.3	N108 N113 S114	N108-S111 CarbonylContact O-C 3.55Å; N108-S111 PolarHBondContact O-N 3.31Å; N108-S111 PolarHBondContact OD1-N 3.17Å; N108-S111 VanDerWaalsContact OD1-N 3.14Å; S111-N113 PolarHBondContact O-N 3.15Å; S111-N113 VanDerWaalsContact O-N 3.1Å; S111-S114 WeakPolarHBondContact O-CB 3.4Å; S111-S114 PolarHBondContact O-N 3.21Å; S111-S114 PolarHBondContact O-OG 2.94Å
112	P	77.1	Confident	88.5	Confident	92 Å²	92	79.2 Å²	79.2	60%	0.597	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.4	-25.4	-170.9	22.3	-33.4	0	0	0	113.6	S114	P112-S114 VanDerWaalsContact C-N 3.29Å; P112-S114 PolarHBondContact O-N 3.42Å
113	N	82.9	Confident	88.7	Confident	167 Å²	167	78.2 Å²	78.2	89%	0.893	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.9	0.6	177.5	-60.3	-25.5	0	0	0	113.7	S111	S111-N113 PolarHBondContact O-N 3.15Å; S111-N113 VanDerWaalsContact O-N 3.1Å
114	S	85.7	Confident	88.9	Confident	42 Å²	42	75.3 Å²	75.3	29%	0.294	41%	0.41	S	S	.	.	S	Bend	trans	-70.3	155.7	175.9	65.4	0	0	0	0	111.1	N108 S111 P112 L116	N108-S114 WeakPolarHBondContact CB-OG 3.31Å; S111-S114 WeakPolarHBondContact O-CB 3.4Å; S111-S114 PolarHBondContact O-N 3.21Å; S111-S114 PolarHBondContact O-OG 2.94Å; P112-S114 VanDerWaalsContact C-N 3.29Å; P112-S114 PolarHBondContact O-N 3.42Å; S114-L116 PolarHBondContact O-N 2.97Å
115	K	88.6	Confident	89.3	Confident	193 Å²	193	73.5 Å²	73.5	84%	0.839	40%	0.397	S	S	*	.	P	Polyproline II helix	trans	-61.1	130.4	176.2	-172.9	-179.1	177.5	-179.4	0	109.7
116	L	88.7	Confident	89.5	Confident	72 Å²	72	74.4 Å²	74.4	38%	0.377	40%	0.399	S	S	.	.	P	Polyproline II helix	trans	-61.2	144.8	173.3	-68.9	77	0	0	0	110.1	N104 C106 H107 S114	N104-L116 HydrophobicContact CB-CD2 4.1Å; N104-L116 WeakPolarHBondContact O-CD2 3.37Å; C106-L116 WeakPolarHBondContact O-CA 3.24Å; H107-L116 VanDerWaalsContact CE1-CD2 3.44Å; H107-L116 WeakPolarHBondContact CE1-CD2 3.27Å; H107-L116 WeakPolarHBondContact NE2-CD2 3.46Å; S114-L116 PolarHBondContact O-N 2.97Å
117	Y	90.1	Very high	89.7	Confident	83 Å²	83	76.8 Å²	76.8	33%	0.325	41%	0.408	S	S	.	.	B	Isolated β-bridge	trans	-121.3	149.9	174.1	60.3	-87.9	0	0	0	109.9	G105 C106	G105-Y117 CarbonylContact C-O 3.54Å; G105-Y117 WeakPolarHBondContact CA-O 3.46Å; C106-Y117 HydrophobicContact CB-CD1 4.09Å; C106-Y117 HydrophobicContact CB-CD2 3.67Å; C106-Y117 HydrophobicContact CB-CE1 3.69Å; C106-Y117 HydrophobicContact CB-CE2 3.23Å; C106-Y117 HydrophobicContact CB-CG 4.08Å; C106-Y117 PolarHBondContact N-O 3.16Å; C106-Y117 PolarHBondContact O-N 3.42Å; C106-Y117 WeakPolarHBondContact SG-CE2 3.36Å
118	P	92.6	Very high	90.1	Very high	107 Å²	107	76.2 Å²	76.2	70%	0.695	41%	0.405	S	S	*	.	P	Polyproline II helix	trans	-64.8	140	-176.1	26	-34.3	0	0	0	111.6
119	A	93.2	Very high	90.5	Very high	18 Å²	18	75.6 Å²	75.6	15%	0.149	40%	0.401	C	S	.	.	P	Polyproline II helix	trans	-68	140.6	169.7	0	0	0	0	0	110.5	L101 C106 P144	L101-A119 WeakPolarHBondContact O-CB 3Å; C106-A119 WeakPolarHBondContact SG-CA 3Å; A119-P144 HydrophobicContact CB-CB 3.77Å
120	T	94.2	Very high	91.1	Very high	77 Å²	77	74.6 Å²	74.6	47%	0.472	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	121.3	178	-56.5	0	0	0	0	109.5	V122 F145	T120-V122 HydrophobicContact CG2-CG1 4.17Å; T120-V122 PolarHBondContact O-N 2.86Å; T120-F145 PolarHBondContact N-O 2.85Å; T120-F145 VanDerWaalsContact O-CB 3.27Å; T120-F145 WeakPolarHBondContact O-CB 3.36Å; T120-F145 PolarHBondContact O-N 3Å
121	P	94	Very high	91.4	Very high	80 Å²	80	74.9 Å²	74.9	52%	0.519	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	117.7	176.2	26	-31.7	0	0	0	110.2	F102 L142	F102-P121 HydrophobicContact CE1-CB 4.41Å; P121-L142 HydrophobicContact CB-CD1 3.84Å; P121-L142 HydrophobicContact CB-CD2 4.29Å; P121-L142 HydrophobicContact CB-CG 4.19Å
122	V	95.3	Very high	91.8	Very high	35 Å²	35	81 Å²	81	21%	0.212	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	163.7	175.5	-57	0	0	0	0	110.7	T120 R124 F143 F145	T120-V122 HydrophobicContact CG2-CG1 4.17Å; T120-V122 PolarHBondContact O-N 2.86Å; V122-R124 HydrophobicContact CG2-CG 4.24Å; V122-F143 HydrophobicContact CG2-CB 4.01Å; V122-F143 HydrophobicContact CG2-CD1 4.06Å; V122-F143 HydrophobicContact CG2-CG 4.48Å; V122-F143 PolarHBondContact N-O 3.07Å; V122-F143 WeakPolarHBondContact O-CB 3.44Å; V122-F143 PolarHBondContact O-N 3.07Å; V122-F145 HydrophobicContact CB-CB 4.43Å; V122-F145 HydrophobicContact CG1-CB 3.92Å; V122-F145 HydrophobicContact CG2-CB 3.65Å
123	S	95.4	Very high	92.7	Very high	65 Å²	65	79.4 Å²	79.4	46%	0.455	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	131.7	171.4	-174.9	0	0	0	0	110.5
124	R	95.4	Very high	93.3	Very high	37 Å²	37	80.5 Å²	80.5	14%	0.14	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	163.8	169.3	-65.3	-61.4	-178.9	-117.1	8.9	110.9	V122 S140 Y141 F143 E150 A156	V122-R124 HydrophobicContact CG2-CG 4.24Å; R124-S140 CarbonylContact O-C 3.59Å; R124-S140 WeakPolarHBondContact O-CA 3.33Å; R124-Y141 HydrophobicContact CB-CD1 4.47Å; R124-Y141 HydrophobicContact CB-CE1 4Å; R124-Y141 PolarHBondContact N-O 3.4Å; R124-Y141 VanDerWaalsContact N-O 3.1Å; R124-Y141 VanDerWaalsContact O-CD1 3.28Å; R124-Y141 WeakPolarHBondContact O-CD1 3.38Å; R124-Y141 PolarHBondContact O-N 2.8Å; R124-F143 HydrophobicContact CB-CB 3.83Å; R124-F143 HydrophobicContact CB-CD2 3.98Å; R124-F143 HydrophobicContact CB-CG 4.03Å; R124-F143 HydrophobicContact CG-CB 3.45Å; R124-F143 VanDerWaalsContact CG-CB 3.45Å; R124-F143 HydrophobicContact CG-CD1 3.89Å; R124-F143 HydrophobicContact CG-CD2 3.75Å; R124-F143 HydrophobicContact CG-CE2 4.44Å; R124-F143 HydrophobicContact CG-CG 3.42Å; R124-F143 VanDerWaalsContact CG-CG 3.42Å; R124-E150 IonicContact CZ-OE1 2.66Å; R124-E150 IonicContact NE-OE1 3.02Å; R124-E150 PolarHBondContact NE-OE1 2.96Å; R124-E150 VanDerWaalsContact NH2-CD 3.33Å; R124-E150 IonicContact NH2-OE1 3.14Å; R124-E150 PolarHBondContact NH2-OE1 2.94Å; R124-E150 IonicContact NH2-OE2 2.81Å; R124-E150 PolarHBondContact NH2-OE2 3.14Å; R124-A156 HydrophobicContact CB-CB 3.97Å; R124-A156 HydrophobicContact CG-CB 4.12Å
125	W	97.2	Very high	93.8	Very high	56 Å²	56	80.4 Å²	80.4	21%	0.212	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	147.9	-178.8	-65.2	79.3	0	0	0	110.8	C138 R139 P157 R160 C163	W125-C138 HydrophobicContact CE3-CB 4.05Å; W125-C138 WeakPolarHBondContact CZ3-O 3.47Å; W125-R139 CarbonylContact C-O 3.44Å; W125-R139 VanDerWaalsContact CA-O 3.27Å; W125-R139 WeakPolarHBondContact CA-O 3.3Å; W125-R139 VanDerWaalsContact CE3-C 3.47Å; W125-P157 HydrophobicContact CB-CB 4.19Å; W125-P157 PolarHBondContact N-O 2.79Å; W125-P157 WeakPolarHBondContact O-CD 2.98Å; W125-R160 HydrophobicContact CD2-CB 3.95Å; W125-R160 HydrophobicContact CD2-CG 4.46Å; W125-R160 HydrophobicContact CE3-CB 3.96Å; W125-R160 HydrophobicContact CE3-CG 3.97Å; W125-R160 HydrophobicContact CH2-CB 3.85Å; W125-R160 HydrophobicContact CH2-CG 4.02Å; W125-R160 HydrophobicContact CZ2-CB 3.83Å; W125-R160 HydrophobicContact CZ3-CB 3.91Å; W125-R160 HydrophobicContact CZ3-CG 3.73Å; W125-C163 HydrophobicContact CB-CB 3.71Å
126	Y	95.6	Very high	94.1	Very high	24 Å²	24	74.7 Å²	74.7	9%	0.094	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	160.2	174.2	75.8	-75.6	0	0	0	109	C90 K92 H128 C138 R139 Y141	C90-Y126 WeakPolarHBondContact O-CB 3.11Å; K92-Y126 HydrophobicContact CB-CD2 3.84Å; K92-Y126 HydrophobicContact CB-CE2 4.01Å; K92-Y126 HydrophobicContact CB-CG 4.25Å; K92-Y126 HydrophobicContact CD-CE2 4.44Å; Y126-H128 HydrophobicContact CD2-CB 4.42Å; Y126-H128 HydrophobicContact CE2-CB 3.66Å; Y126-C138 CarbonylContact O-C 3.57Å; Y126-C138 WeakPolarHBondContact O-CA 3.48Å; Y126-R139 HydrophobicContact CD1-CB 4.31Å; Y126-R139 VanDerWaalsContact CD1-O 3.24Å; Y126-R139 WeakPolarHBondContact CD1-O 3.49Å; Y126-R139 HydrophobicContact CE1-CB 3.7Å; Y126-R139 PolarHBondContact N-O 3.2Å; Y126-R139 PolarHBondContact O-N 3.43Å; Y126-Y141 AromaticContact CD1-CD1 3.37Å; Y126-Y141 HydrophobicContact CD1-CD1 3.37Å; Y126-Y141 AromaticContact CD1-CE1 3.74Å; Y126-Y141 HydrophobicContact CD1-CE1 3.74Å; Y126-Y141 HydrophobicContact CD1-CG 4.05Å; Y126-Y141 AromaticContact CE1-CD1 3.96Å; Y126-Y141 HydrophobicContact CE1-CD1 3.96Å; Y126-Y141 HydrophobicContact CE1-CG 4.21Å; Y126-Y141 HydrophobicContact CG-CD1 4.27Å; Y126-Y141 HydrophobicContact CG-CE1 4.21Å
127	R	96.2	Very high	94.5	Very high	49 Å²	49	75.1 Å²	75.1	19%	0.185	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	117.4	172.9	-179.6	169.6	177.6	-161.6	2	108.8	L63 C90 I129 D136 C167 Y168	L63-R127 HydrophobicContact CB-CB 4.42Å; L63-R127 HydrophobicContact CD1-CB 4.19Å; L63-R127 HydrophobicContact CD1-CG 4.26Å; L63-R127 WeakPolarHBondContact CD1-O 3.46Å; C90-R127 PolarHBondContact O-N 2.03Å; R127-I129 HydrophobicContact CG-CD1 4.31Å; R127-I129 HydrophobicContact CG-CG1 3.95Å; R127-D136 IonicContact CZ-OD1 3.61Å; R127-D136 IonicContact CZ-OD2 3.51Å; R127-D136 IonicContact NE-OD1 2.8Å; R127-D136 PolarHBondContact NE-OD1 3.43Å; R127-D136 IonicContact NE-OD2 3.52Å; R127-D136 IonicContact NH2-OD1 3.55Å; R127-D136 IonicContact NH2-OD2 2.69Å; R127-D136 PolarHBondContact NH2-OD2 3.29Å; R127-C167 HydrophobicContact CB-CB 3.71Å; R127-C167 WeakPolarHBondContact CD-O 3.16Å; R127-C167 HydrophobicContact CG-CB 4.47Å; R127-C167 PolarHBondContact NH1-O 2.83Å; R127-Y168 HydrophobicContact CG-CE2 4.04Å
128	H	95	Very high	94.8	Very high	39 Å²	39	71.6 Å²	71.6	18%	0.181	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	118.3	174.8	178.9	58.9	0	0	0	109.1	Y126 D136 E137 R139	Y126-H128 HydrophobicContact CD2-CB 4.42Å; Y126-H128 HydrophobicContact CE2-CB 3.66Å; H128-D136 WeakPolarHBondContact O-CA 3.2Å; H128-E137 PolarHBondContact N-O 2.9Å; H128-E137 PolarHBondContact O-N 2.03Å; H128-R139 HydrophobicContact CB-CB 4.38Å; H128-R139 HydrophobicContact CB-CG 3.93Å; H128-R139 PolarHBondContact CD2-NE 3.43Å; H128-R139 PolarHBondContact CD2-NH1 3.04Å; H128-R139 PolarHBondContact NE2-NH1 3.36Å
129	I	93.1	Very high	95.1	Very high	38 Å²	38	70.9 Å²	70.9	20%	0.195	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	128.9	173.9	-53.7	-176.7	0	0	0	108.4	L63 R127 Y131 V135	L63-I129 HydrophobicContact CD1-CD1 3.95Å; L63-I129 HydrophobicContact CD1-CG1 4.06Å; L63-I129 HydrophobicContact CD2-CD1 3.52Å; L63-I129 HydrophobicContact CD2-CG1 4.49Å; L63-I129 HydrophobicContact CG-CD1 4.32Å; R127-I129 HydrophobicContact CG-CD1 4.31Å; R127-I129 HydrophobicContact CG-CG1 3.95Å; I129-Y131 HydrophobicContact CG2-CD1 4.13Å; I129-Y131 HydrophobicContact CG2-CD2 4.22Å; I129-Y131 HydrophobicContact CG2-CE1 3.81Å; I129-Y131 HydrophobicContact CG2-CE2 3.9Å; I129-Y131 HydrophobicContact CG2-CG 4.33Å; I129-V135 CarbonylContact C-O 3.42Å; I129-V135 WeakPolarHBondContact CA-O 3.31Å
130	D	93.4	Very high	95.2	Very high	57 Å²	57	73.2 Å²	73.2	31%	0.305	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	107.1	168.3	-173.2	-33.8	0	0	0	107.7	E132 A133 K134 V135	D130-E132 VanDerWaalsContact C-N 3.33Å; D130-E132 PolarHBondContact OD1-N 3.36Å; D130-A133 HydrophobicContact CB-CB 4.11Å; D130-A133 PolarHBondContact OD1-N 3.48Å; D130-K134 CarbonylContact O-C 3.58Å; D130-K134 WeakPolarHBondContact O-CA 2.99Å; D130-K134 PolarHBondContact O-N 3Å; D130-V135 HydrophobicContact CB-CB 4.16Å; D130-V135 PolarHBondContact N-O 3.39Å; D130-V135 PolarHBondContact O-N 3.16Å
131	Y	89.9	Confident	95.2	Very high	181 Å²	181	70.5 Å²	70.5	71%	0.71	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.1	-30.5	-177.1	-64.6	-75.3	0	0	0	112.6	I129	I129-Y131 HydrophobicContact CG2-CD1 4.13Å; I129-Y131 HydrophobicContact CG2-CD2 4.22Å; I129-Y131 HydrophobicContact CG2-CE1 3.81Å; I129-Y131 HydrophobicContact CG2-CE2 3.9Å; I129-Y131 HydrophobicContact CG2-CG 4.33Å
132	E	94.6	Very high	95.2	Very high	189 Å²	189	71.7 Å²	71.7	88%	0.883	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.6	-45.9	-179.6	-64.5	-177.1	-179.6	0	0	110.3	D130 K134	D130-E132 VanDerWaalsContact C-N 3.33Å; D130-E132 PolarHBondContact OD1-N 3.36Å; E132-K134 PolarHBondContact O-N 3.32Å
133	A	95.8	Very high	95.1	Very high	59 Å²	59	70 Å²	70	49%	0.488	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.3	-5.1	177.1	0	0	0	0	0	113.6	D130 V135	D130-A133 HydrophobicContact CB-CB 4.11Å; D130-A133 PolarHBondContact OD1-N 3.48Å; A133-V135 HydrophobicContact CB-CG2 3.85Å; A133-V135 PolarHBondContact O-N 2.87Å
134	K	94.5	Very high	95	Very high	190 Å²	190	66.9 Å²	66.9	83%	0.826	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.1	38.9	-171.9	-57.9	-177.3	-179	-179.4	0	112.6	D130 E132	D130-K134 CarbonylContact O-C 3.58Å; D130-K134 WeakPolarHBondContact O-CA 2.99Å; D130-K134 PolarHBondContact O-N 3Å; E132-K134 PolarHBondContact O-N 3.32Å
135	V	96.4	Very high	94.9	Very high	40 Å²	40	68 Å²	68	24%	0.242	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	128.8	176.6	175.7	0	0	0	0	108.4	I129 D130 A133 E137	I129-V135 CarbonylContact C-O 3.42Å; I129-V135 WeakPolarHBondContact CA-O 3.31Å; D130-V135 HydrophobicContact CB-CB 4.16Å; D130-V135 PolarHBondContact N-O 3.39Å; D130-V135 PolarHBondContact O-N 3.16Å; A133-V135 HydrophobicContact CB-CG2 3.85Å; A133-V135 PolarHBondContact O-N 2.87Å; V135-E137 HydrophobicContact CG1-CG 3.79Å
136	D	95.6	Very high	94.6	Very high	72 Å²	72	65.3 Å²	65.3	39%	0.385	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141	97.5	169.7	-176.1	-0.8	0	0	0	107.7	R127 H128 Y168	R127-D136 IonicContact CZ-OD1 3.61Å; R127-D136 IonicContact CZ-OD2 3.51Å; R127-D136 IonicContact NE-OD1 2.8Å; R127-D136 PolarHBondContact NE-OD1 3.43Å; R127-D136 IonicContact NE-OD2 3.52Å; R127-D136 IonicContact NH2-OD1 3.55Å; R127-D136 IonicContact NH2-OD2 2.69Å; R127-D136 PolarHBondContact NH2-OD2 3.29Å; H128-D136 WeakPolarHBondContact O-CA 3.2Å; D136-Y168 PolarHBondContact O-OH 3.4Å; D136-Y168 WeakPolarHBondContact OD1-CE1 3.46Å; D136-Y168 PolarHBondContact OD1-OH 3.3Å
137	E	96.3	Very high	94.3	Very high	81 Å²	81	69 Å²	69	38%	0.379	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	156.4	-175.3	69.8	-176.4	175	0	0	113.6	H128 V135 R139 Y168	H128-E137 PolarHBondContact N-O 2.9Å; H128-E137 PolarHBondContact O-N 2.03Å; V135-E137 HydrophobicContact CG1-CG 3.79Å; E137-R139 HydrophobicContact CG-CG 3.95Å; E137-R139 IonicContact OE1-CZ 2.65Å; E137-R139 IonicContact OE1-NE 3.15Å; E137-R139 PolarHBondContact OE1-NE 3.41Å; E137-R139 IonicContact OE1-NH2 2.7Å; E137-R139 PolarHBondContact OE1-NH2 2.78Å; E137-Y168 VanDerWaalsContact C-OH 3.31Å; E137-Y168 WeakPolarHBondContact CA-OH 3.36Å; E137-Y168 PolarHBondContact N-OH 2.92Å; E137-Y168 VanDerWaalsContact N-OH 3.08Å
138	C	97.7	Very high	93.7	Very high	9 Å²	9	67.8 Å²	67.8	6%	0.061	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	122	167.9	-75.7	0	0	0	0	111.1	W125 Y126 R160 C163 L164	W125-C138 HydrophobicContact CE3-CB 4.05Å; W125-C138 WeakPolarHBondContact CZ3-O 3.47Å; Y126-C138 CarbonylContact O-C 3.57Å; Y126-C138 WeakPolarHBondContact O-CA 3.48Å; C138-R160 HydrophobicContact CB-CG 4.31Å; C138-C163 HydrophobicContact CB-CB 3.83Å; C138-C163 WeakPolarHBondContact CB-SG 3.45Å; C138-C163 WeakPolarHBondContact SG-CB 3.38Å; C138-C163 CovalentContact SG-SG 2.03Å; C138-C163 PolarHBondContact SG-SG 2.87Å; C138-L164 PolarHBondContact SG-N 3.3Å
139	R	97.5	Very high	93.3	Very high	92 Å²	92	67.3 Å²	67.3	35%	0.347	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	148	175.1	-68.4	-169.1	173.8	169.3	2.8	111.9	W125 Y126 H128 E137	W125-R139 CarbonylContact C-O 3.44Å; W125-R139 VanDerWaalsContact CA-O 3.27Å; W125-R139 WeakPolarHBondContact CA-O 3.3Å; W125-R139 VanDerWaalsContact CE3-C 3.47Å; Y126-R139 HydrophobicContact CD1-CB 4.31Å; Y126-R139 VanDerWaalsContact CD1-O 3.24Å; Y126-R139 WeakPolarHBondContact CD1-O 3.49Å; Y126-R139 HydrophobicContact CE1-CB 3.7Å; Y126-R139 PolarHBondContact N-O 3.2Å; Y126-R139 PolarHBondContact O-N 3.43Å; H128-R139 HydrophobicContact CB-CB 4.38Å; H128-R139 HydrophobicContact CB-CG 3.93Å; H128-R139 PolarHBondContact CD2-NE 3.43Å; H128-R139 PolarHBondContact CD2-NH1 3.04Å; H128-R139 PolarHBondContact NE2-NH1 3.36Å; E137-R139 HydrophobicContact CG-CG 3.95Å; E137-R139 IonicContact OE1-CZ 2.65Å; E137-R139 IonicContact OE1-NE 3.15Å; E137-R139 PolarHBondContact OE1-NE 3.41Å; E137-R139 IonicContact OE1-NH2 2.7Å; E137-R139 PolarHBondContact OE1-NH2 2.78Å
140	S	96.4	Very high	92.9	Very high	67 Å²	67	66.9 Å²	66.9	47%	0.469	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	148.7	169.9	59.7	0	0	0	0	111.7	R124	R124-S140 CarbonylContact O-C 3.59Å; R124-S140 WeakPolarHBondContact O-CA 3.33Å
141	Y	94.9	Very high	92.4	Very high	21 Å²	21	70.2 Å²	70.2	8%	0.082	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	162.6	173.6	72.4	-63.1	0	0	0	111.5	K92 M93 L98 R124 Y126 F143	K92-Y141 HydrophobicContact CG-CD2 4.1Å; K92-Y141 HydrophobicContact CG-CE2 3.89Å; M93-Y141 HydrophobicContact CB-CE2 4.42Å; M93-Y141 PolarHBondContact N-OH 3.32Å; L98-Y141 HydrophobicContact CD1-CE2 4.46Å; R124-Y141 HydrophobicContact CB-CD1 4.47Å; R124-Y141 HydrophobicContact CB-CE1 4Å; R124-Y141 PolarHBondContact N-O 3.4Å; R124-Y141 VanDerWaalsContact N-O 3.1Å; R124-Y141 VanDerWaalsContact O-CD1 3.28Å; R124-Y141 WeakPolarHBondContact O-CD1 3.38Å; R124-Y141 PolarHBondContact O-N 2.8Å; Y126-Y141 AromaticContact CD1-CD1 3.37Å; Y126-Y141 HydrophobicContact CD1-CD1 3.37Å; Y126-Y141 AromaticContact CD1-CE1 3.74Å; Y126-Y141 HydrophobicContact CD1-CE1 3.74Å; Y126-Y141 HydrophobicContact CD1-CG 4.05Å; Y126-Y141 AromaticContact CE1-CD1 3.96Å; Y126-Y141 HydrophobicContact CE1-CD1 3.96Å; Y126-Y141 HydrophobicContact CE1-CG 4.21Å; Y126-Y141 HydrophobicContact CG-CD1 4.27Å; Y126-Y141 HydrophobicContact CG-CE1 4.21Å; Y141-F143 HydrophobicContact CE2-CD2 4.13Å; Y141-F143 AromaticContact CZ-CD2 3.79Å; Y141-F143 PolarHBondContact O-N 3.4Å; Y141-F143 WeakPolarHBondContact OH-CD2 3.49Å
142	L	93.9	Very high	92	Very high	104 Å²	104	66.5 Å²	66.5	55%	0.545	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73	121.7	174.2	-161.8	70.9	0	0	0	109.7	F102 P121	F102-L142 HydrophobicContact CE1-CD2 4.22Å; F102-L142 HydrophobicContact CZ-CD2 3.86Å; F102-L142 HydrophobicContact CZ-CG 3.94Å; P121-L142 HydrophobicContact CB-CD1 3.84Å; P121-L142 HydrophobicContact CB-CD2 4.29Å; P121-L142 HydrophobicContact CB-CG 4.19Å
143	F	92.5	Very high	91.5	Very high	0 Å²	0	59 Å²	59	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	128.7	-176.2	-171.9	-88.4	0	0	0	109.8	M93 V122 R124 Y141 F145 E150 W154 A156	M93-F143 HydrophobicContact CE-CD2 4.34Å; M93-F143 HydrophobicContact CE-CE1 4.4Å; M93-F143 HydrophobicContact CE-CE2 3.54Å; M93-F143 HydrophobicContact CE-CZ 3.57Å; V122-F143 HydrophobicContact CG2-CB 4.01Å; V122-F143 HydrophobicContact CG2-CD1 4.06Å; V122-F143 HydrophobicContact CG2-CG 4.48Å; V122-F143 PolarHBondContact N-O 3.07Å; V122-F143 WeakPolarHBondContact O-CB 3.44Å; V122-F143 PolarHBondContact O-N 3.07Å; R124-F143 HydrophobicContact CB-CB 3.83Å; R124-F143 HydrophobicContact CB-CD2 3.98Å; R124-F143 HydrophobicContact CB-CG 4.03Å; R124-F143 HydrophobicContact CG-CB 3.45Å; R124-F143 VanDerWaalsContact CG-CB 3.45Å; R124-F143 HydrophobicContact CG-CD1 3.89Å; R124-F143 HydrophobicContact CG-CD2 3.75Å; R124-F143 HydrophobicContact CG-CE2 4.44Å; R124-F143 HydrophobicContact CG-CG 3.42Å; R124-F143 VanDerWaalsContact CG-CG 3.42Å; Y141-F143 HydrophobicContact CE2-CD2 4.13Å; Y141-F143 AromaticContact CZ-CD2 3.79Å; Y141-F143 PolarHBondContact O-N 3.4Å; Y141-F143 WeakPolarHBondContact OH-CD2 3.49Å; F143-F145 HydrophobicContact CD1-CB 4.31Å; F143-F145 PolarHBondContact O-N 2.03Å; F143-F145 VanDerWaalsContact O-N 3.08Å; F143-E150 HydrophobicContact CE1-CB 4.45Å; F143-W154 AromaticContact CE2-CD1 3.95Å; F143-A156 HydrophobicContact CD2-CB 4.28Å; F143-A156 HydrophobicContact CE2-CB 3.83Å; F143-A156 HydrophobicContact CZ-CB 4.41Å
144	P	93.4	Very high	91.1	Very high	0 Å²	0	56.9 Å²	56.9	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	90.4	174.6	30.7	-31	0	0	0	108.8	M93 L98 L101 F102 A119 C146	M93-P144 HydrophobicContact SD-CG 3.93Å; L98-P144 VanDerWaalsContact CD1-CD 3.44Å; L98-P144 HydrophobicContact CD1-CG 3.9Å; L101-P144 HydrophobicContact CB-CB 3.79Å; L101-P144 HydrophobicContact CB-CG 3.81Å; L101-P144 HydrophobicContact CD1-CG 4.04Å; F102-P144 HydrophobicContact CD1-CB 3.98Å; F102-P144 HydrophobicContact CD2-CB 4.03Å; F102-P144 HydrophobicContact CD2-CG 4.12Å; F102-P144 HydrophobicContact CE1-CB 3.8Å; F102-P144 HydrophobicContact CE2-CB 3.87Å; F102-P144 HydrophobicContact CE2-CG 3.86Å; F102-P144 HydrophobicContact CG-CB 4.07Å; F102-P144 HydrophobicContact CZ-CB 3.73Å; F102-P144 HydrophobicContact CZ-CG 4.14Å; A119-P144 HydrophobicContact CB-CB 3.77Å; P144-C146 PolarHBondContact O-N 2.9Å
145	F	93.3	Very high	90.8	Very high	59 Å²	59	49 Å²	49	26%	0.259	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	121.5	-179.2	171.9	-105.2	0	0	0	111.1	T120 V122 F143 E147 E150	T120-F145 PolarHBondContact N-O 2.85Å; T120-F145 VanDerWaalsContact O-CB 3.27Å; T120-F145 WeakPolarHBondContact O-CB 3.36Å; T120-F145 PolarHBondContact O-N 3Å; V122-F145 HydrophobicContact CB-CB 4.43Å; V122-F145 HydrophobicContact CG1-CB 3.92Å; V122-F145 HydrophobicContact CG2-CB 3.65Å; F143-F145 HydrophobicContact CD1-CB 4.31Å; F143-F145 PolarHBondContact O-N 2.03Å; F143-F145 VanDerWaalsContact O-N 3.08Å; F145-E147 HydrophobicContact CZ-CB 4.04Å; F145-E150 HydrophobicContact CD2-CB 4.01Å; F145-E150 VanDerWaalsContact CD2-OE2 3.22Å; F145-E150 WeakPolarHBondContact CD2-OE2 3.33Å; F145-E150 HydrophobicContact CE2-CB 4Å; F145-E150 HydrophobicContact CE2-CG 4.44Å; F145-E150 WeakPolarHBondContact CE2-OE2 3.34Å
146	C	91.3	Very high	90.6	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	23%	0.234	C	C	.	.			trans	-128.4	126.3	165.6	-56.8	0	0	0	0	106.6	C106 P144 D148 Y149 E150	C106-C146 VanDerWaalsContact CA-SG 3.55Å; C106-C146 HydrophobicContact CB-CB 3.57Å; C106-C146 WeakPolarHBondContact CB-SG 3.06Å; C106-C146 WeakPolarHBondContact SG-CA 3.38Å; C106-C146 WeakPolarHBondContact SG-CB 3.2Å; C106-C146 CovalentContact SG-SG 2.01Å; C106-C146 PolarHBondContact SG-SG 2.63Å; P144-C146 PolarHBondContact O-N 2.9Å; C146-D148 VanDerWaalsContact C-N 3.3Å; C146-D148 PolarHBondContact O-N 3.03Å; C146-Y149 HydrophobicContact CB-CD2 3.77Å; C146-Y149 HydrophobicContact CB-CG 4.21Å; C146-Y149 PolarHBondContact O-N 2.05Å; C146-Y149 VanDerWaalsContact O-N 3.08Å; C146-E150 PolarHBondContact O-N 3.45Å
147	E	88.4	Confident	90.6	Very high	101 Å²	101	43.9 Å²	43.9	47%	0.472	22%	0.216	S	C	.	.	H	α-helix	trans	-55.6	-45.3	-171.5	-176.1	176.5	-174.9	0	0	112.4	F145 K151	F145-E147 HydrophobicContact CZ-CB 4.04Å; E147-K151 HydrophobicContact CG-CD 4.14Å; E147-K151 WeakPolarHBondContact O-CB 3.01Å; E147-K151 WeakPolarHBondContact O-CG 3.22Å; E147-K151 PolarHBondContact O-N 2.04Å; E147-K151 IonicContact OE1-NZ 3.75Å; E147-K151 PolarHBondContact OE1-NZ 2.98Å
148	D	84	Confident	90.6	Very high	24 Å²	24	42.7 Å²	42.7	13%	0.128	21%	0.214	C	C	.	.	H	α-helix	trans	-68.9	-35.7	179.6	-74.1	-28.3	0	0	0	112.8	L109 C146 N152	L109-D148 HydrophobicContact CB-CB 4.26Å; L109-D148 HydrophobicContact CD1-CB 3.94Å; L109-D148 HydrophobicContact CG-CB 3.9Å; L109-D148 PolarHBondContact N-OD2 2.87Å; C146-D148 VanDerWaalsContact C-N 3.3Å; C146-D148 PolarHBondContact O-N 3.03Å; D148-N152 VanDerWaalsContact O-CB 3.28Å; D148-N152 WeakPolarHBondContact O-CB 3.44Å; D148-N152 PolarHBondContact O-N 3.12Å; D148-N152 PolarHBondContact O-ND2 2.9Å
149	Y	85.8	Confident	90.5	Very high	30 Å²	30	44.9 Å²	44.9	12%	0.118	23%	0.227	C	C	.	.	H	α-helix	trans	-75.7	-43.1	-179.3	-76.6	-108.3	0	0	0	111.5	L101 H107 L109 C146 K151 N152 V153 W154	L101-Y149 HydrophobicContact CD1-CD1 4.06Å; L101-Y149 HydrophobicContact CD1-CE1 4.46Å; L101-Y149 HydrophobicContact CD1-CG 4.36Å; L101-Y149 HydrophobicContact CD2-CD1 4.2Å; L101-Y149 HydrophobicContact CD2-CD2 4.34Å; L101-Y149 HydrophobicContact CD2-CE1 3.94Å; L101-Y149 HydrophobicContact CD2-CE2 4.1Å; L101-Y149 HydrophobicContact CD2-CG 4.39Å; H107-Y149 HydrophobicContact CB-CE2 4.45Å; L109-Y149 HydrophobicContact CD1-CD2 4.4Å; L109-Y149 HydrophobicContact CD1-CE2 4.45Å; L109-Y149 HydrophobicContact CD2-CD2 4.47Å; L109-Y149 HydrophobicContact CD2-CE2 3.74Å; L109-Y149 HydrophobicContact CG-CD2 4.4Å; L109-Y149 HydrophobicContact CG-CE2 4.08Å; C146-Y149 HydrophobicContact CB-CD2 3.77Å; C146-Y149 HydrophobicContact CB-CG 4.21Å; C146-Y149 PolarHBondContact O-N 2.05Å; C146-Y149 VanDerWaalsContact O-N 3.08Å; Y149-K151 VanDerWaalsContact C-N 3.28Å; Y149-K151 PolarHBondContact O-N 2.7Å; Y149-N152 PolarHBondContact O-N 3.44Å; Y149-V153 HydrophobicContact CD1-CB 3.97Å; Y149-V153 HydrophobicContact CD1-CG1 4.07Å; Y149-V153 HydrophobicContact CD1-CG2 3.94Å; Y149-V153 HydrophobicContact CE1-CG2 4.45Å; Y149-V153 HydrophobicContact CG-CB 4.42Å; Y149-V153 HydrophobicContact CG-CG2 4.28Å; Y149-V153 CarbonylContact O-C 3.12Å; Y149-V153 WeakPolarHBondContact O-CA 3.07Å; Y149-V153 WeakPolarHBondContact O-CB 3.43Å; Y149-V153 PolarHBondContact O-N 3.04Å; Y149-W154 PolarHBondContact O-N 3.08Å
150	E	85.5	Confident	90.5	Very high	29 Å²	29	46.9 Å²	46.9	14%	0.136	24%	0.235	C	C	.	.	H	α-helix	trans	-60.8	-42.1	176.8	175.9	164.6	-110.4	0	0	110.5	R124 F143 F145 C146 P155	R124-E150 IonicContact CZ-OE1 2.66Å; R124-E150 IonicContact NE-OE1 3.02Å; R124-E150 PolarHBondContact NE-OE1 2.96Å; R124-E150 VanDerWaalsContact NH2-CD 3.33Å; R124-E150 IonicContact NH2-OE1 3.14Å; R124-E150 PolarHBondContact NH2-OE1 2.94Å; R124-E150 IonicContact NH2-OE2 2.81Å; R124-E150 PolarHBondContact NH2-OE2 3.14Å; F143-E150 HydrophobicContact CE1-CB 4.45Å; F145-E150 HydrophobicContact CD2-CB 4.01Å; F145-E150 VanDerWaalsContact CD2-OE2 3.22Å; F145-E150 WeakPolarHBondContact CD2-OE2 3.33Å; F145-E150 HydrophobicContact CE2-CB 4Å; F145-E150 HydrophobicContact CE2-CG 4.44Å; F145-E150 WeakPolarHBondContact CE2-OE2 3.34Å; C146-E150 PolarHBondContact O-N 3.45Å; E150-P155 WeakPolarHBondContact O-CA 3.06Å; E150-P155 WeakPolarHBondContact O-CB 3.2Å; E150-P155 VanDerWaalsContact O-N 3.16Å
151	K	82.9	Confident	90.6	Very high	127 Å²	127	50.1 Å²	50.1	55%	0.552	24%	0.243	S	C	*	.	H	α-helix	trans	-73.8	-37.7	-178.3	-69.9	174.8	-179.7	175.3	0	113.4	E147 Y149	E147-K151 HydrophobicContact CG-CD 4.14Å; E147-K151 WeakPolarHBondContact O-CB 3.01Å; E147-K151 WeakPolarHBondContact O-CG 3.22Å; E147-K151 PolarHBondContact O-N 2.04Å; E147-K151 IonicContact OE1-NZ 3.75Å; E147-K151 PolarHBondContact OE1-NZ 2.98Å; Y149-K151 VanDerWaalsContact C-N 3.28Å; Y149-K151 PolarHBondContact O-N 2.7Å
152	N	81.3	Confident	90.7	Very high	102 Å²	102	52.3 Å²	52.3	55%	0.545	25%	0.254	S	S	.	.	H	α-helix	trans	-114.8	-25.4	-166	-53.5	-66.2	0	0	0	114.6	D148 Y149	D148-N152 VanDerWaalsContact O-CB 3.28Å; D148-N152 WeakPolarHBondContact O-CB 3.44Å; D148-N152 PolarHBondContact O-N 3.12Å; D148-N152 PolarHBondContact O-ND2 2.9Å; Y149-N152 PolarHBondContact O-N 3.44Å
153	V	83.1	Confident	90.8	Very high	32 Å²	32	47.3 Å²	47.3	19%	0.194	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-110.4	-54	-169.9	-176.9	0	0	0	0	111.2	R88 M97 L109 Y149	R88-V153 WeakPolarHBondContact CD-O 3.41Å; R88-V153 PolarHBondContact NH1-O 3.13Å; M97-V153 HydrophobicContact CE-CG1 3.82Å; M97-V153 HydrophobicContact SD-CG1 4.21Å; L109-V153 HydrophobicContact CD1-CG2 3.6Å; Y149-V153 HydrophobicContact CD1-CB 3.97Å; Y149-V153 HydrophobicContact CD1-CG1 4.07Å; Y149-V153 HydrophobicContact CD1-CG2 3.94Å; Y149-V153 HydrophobicContact CE1-CG2 4.45Å; Y149-V153 HydrophobicContact CG-CB 4.42Å; Y149-V153 HydrophobicContact CG-CG2 4.28Å; Y149-V153 CarbonylContact O-C 3.12Å; Y149-V153 WeakPolarHBondContact O-CA 3.07Å; Y149-V153 WeakPolarHBondContact O-CB 3.43Å; Y149-V153 PolarHBondContact O-N 3.04Å
154	W	87.8	Confident	91	Very high	15 Å²	15	51.2 Å²	51.2	6%	0.057	25%	0.248	C	C	.	.			trans	-137.8	67.5	-173.7	-151.2	-84.9	0	0	0	111.7	V60 D91 M93 P94 F143 Y149 A156	V60-W154 HydrophobicContact CG1-CH2 4.4Å; D91-W154 HydrophobicContact CB-CH2 4.26Å; D91-W154 HydrophobicContact CB-CZ2 3.74Å; D91-W154 WeakPolarHBondContact O-CZ2 3.05Å; D91-W154 PolarHBondContact O-NE1 2.63Å; D91-W154 VanDerWaalsContact O-NE1 3.16Å; M93-W154 HydrophobicContact CE-CB 3.88Å; M93-W154 HydrophobicContact CE-CG 4.01Å; P94-W154 VanDerWaalsContact CD-CH2 3.49Å; P94-W154 HydrophobicContact CG-CH2 3.9Å; P94-W154 HydrophobicContact CG-CZ3 3.99Å; F143-W154 AromaticContact CE2-CD1 3.95Å; Y149-W154 PolarHBondContact O-N 3.08Å; W154-A156 PolarHBondContact O-N 3.47Å
155	P	89.8	Confident	91.1	Very high	24 Å²	24	56 Å²	56	16%	0.156	27%	0.27	C	S	.	.			trans	-66.9	106.9	176.3	29.1	-35.6	0	0	0	109.4	S85 P86 R88 G89 E150	S85-P155 WeakPolarHBondContact O-CG 3.32Å; P86-P155 CarbonylContact C-O 3.49Å; P86-P155 VanDerWaalsContact C-O 3.31Å; P86-P155 VanDerWaalsContact CA-O 3.23Å; P86-P155 WeakPolarHBondContact CA-O 3.31Å; R88-P155 HydrophobicContact CB-CG 4.03Å; G89-P155 VanDerWaalsContact CA-O 3.23Å; G89-P155 WeakPolarHBondContact CA-O 3.11Å; G89-P155 PolarHBondContact N-O 3.24Å; E150-P155 WeakPolarHBondContact O-CA 3.06Å; E150-P155 WeakPolarHBondContact O-CB 3.2Å; E150-P155 VanDerWaalsContact O-N 3.16Å
156	A	92.1	Very high	91.2	Very high	4 Å²	4	56.8 Å²	56.8	3%	0.033	27%	0.272	C	S	.	.			trans	-103	143.2	-178.7	0	0	0	0	0	111.4	R124 F143 W154 T158	R124-A156 HydrophobicContact CB-CB 3.97Å; R124-A156 HydrophobicContact CG-CB 4.12Å; F143-A156 HydrophobicContact CD2-CB 4.28Å; F143-A156 HydrophobicContact CE2-CB 3.83Å; F143-A156 HydrophobicContact CZ-CB 4.41Å; W154-A156 PolarHBondContact O-N 3.47Å; A156-T158 PolarHBondContact O-N 2.85Å
157	P	95.4	Very high	91.4	Very high	0 Å²	0	56.8 Å²	56.8	0%	0	27%	0.272	C	S	.	.			trans	-52.7	128	173	-27.4	34.2	0	0	0	112.2	P86 W125 Q162 C163	P86-P157 HydrophobicContact CB-CG 4.29Å; P86-P157 WeakPolarHBondContact O-CD 3Å; W125-P157 HydrophobicContact CB-CB 4.19Å; W125-P157 PolarHBondContact N-O 2.79Å; W125-P157 WeakPolarHBondContact O-CD 2.98Å; P157-Q162 HydrophobicContact CB-CB 3.86Å; P157-C163 HydrophobicContact CB-CB 3.89Å; P157-C163 HydrophobicContact CG-CB 4.16Å
158	T	95.4	Very high	91.6	Very high	57 Å²	57	56.2 Å²	56.2	35%	0.35	27%	0.266	S	S	.	.	S	Bend	trans	-84.5	-23.3	-178.3	63.9	0	0	0	0	112.2	A156 Q162	A156-T158 PolarHBondContact O-N 2.85Å; T158-Q162 PolarHBondContact OG1-NE2 2.74Å; T158-Q162 PolarHBondContact OG1-OE1 3.43Å
159	T	96.9	Very high	91.9	Very high	54 Å²	54	57.8 Å²	57.8	33%	0.331	27%	0.273	S	S	.	.	S	Bend	trans	-129.1	161	178.4	70.2	0	0	0	0	111.5	Q161 Q162 C163	T159-Q161 VanDerWaalsContact C-N 3.28Å; T159-Q161 PolarHBondContact O-N 2.96Å; T159-Q162 PolarHBondContact O-N 3.46Å; T159-Q162 WeakPolarHBondContact OG1-CG 3.26Å; T159-Q162 PolarHBondContact OG1-N 3.34Å; T159-C163 PolarHBondContact O-N 2.7Å; T159-C163 VanDerWaalsContact O-N 3.09Å
160	R	97.3	Very high	92.3	Very high	135 Å²	135	59.3 Å²	59.3	51%	0.509	28%	0.281	S	S	.	.	H	α-helix	trans	-59.7	-40.4	174.9	-171.5	180	-176.8	-143.8	0.9	111.7	W125 C138 Q162 C163 L164	W125-R160 HydrophobicContact CD2-CB 3.95Å; W125-R160 HydrophobicContact CD2-CG 4.46Å; W125-R160 HydrophobicContact CE3-CB 3.96Å; W125-R160 HydrophobicContact CE3-CG 3.97Å; W125-R160 HydrophobicContact CH2-CB 3.85Å; W125-R160 HydrophobicContact CH2-CG 4.02Å; W125-R160 HydrophobicContact CZ2-CB 3.83Å; W125-R160 HydrophobicContact CZ3-CB 3.91Å; W125-R160 HydrophobicContact CZ3-CG 3.73Å; C138-R160 HydrophobicContact CB-CG 4.31Å; R160-Q162 VanDerWaalsContact C-N 3.33Å; R160-Q162 PolarHBondContact O-N 3.06Å; R160-C163 WeakPolarHBondContact O-CB 3.44Å; R160-C163 PolarHBondContact O-N 2.8Å; R160-C163 VanDerWaalsContact O-N 3.14Å; R160-L164 HydrophobicContact CG-CD1 4.38Å; R160-L164 WeakPolarHBondContact O-CG 3.33Å; R160-L164 PolarHBondContact O-N 3.14Å
161	Q	97.5	Very high	92.6	Very high	135 Å²	135	60.9 Å²	60.9	63%	0.631	29%	0.289	S	S	*	.	H	α-helix	trans	-62.4	-40.8	178.8	-68.3	76.6	7.9	0	0	111.3	T159 L164 H165	T159-Q161 VanDerWaalsContact C-N 3.28Å; T159-Q161 PolarHBondContact O-N 2.96Å; Q161-L164 PolarHBondContact O-N 3.22Å; Q161-H165 WeakPolarHBondContact O-CB 3.41Å; Q161-H165 PolarHBondContact O-N 2.89Å
162	Q	96.2	Very high	93.2	Very high	66 Å²	66	57.1 Å²	57.1	31%	0.308	27%	0.274	S	S	.	.	H	α-helix	trans	-62.4	-43.7	172.7	-75.3	179.5	-6.6	0	0	111.1	P157 T158 T159 R160 L164 H165 Y166	P157-Q162 HydrophobicContact CB-CB 3.86Å; T158-Q162 PolarHBondContact OG1-NE2 2.74Å; T158-Q162 PolarHBondContact OG1-OE1 3.43Å; T159-Q162 PolarHBondContact O-N 3.46Å; T159-Q162 WeakPolarHBondContact OG1-CG 3.26Å; T159-Q162 PolarHBondContact OG1-N 3.34Å; R160-Q162 VanDerWaalsContact C-N 3.33Å; R160-Q162 PolarHBondContact O-N 3.06Å; Q162-L164 VanDerWaalsContact C-N 3.35Å; Q162-L164 PolarHBondContact O-N 3.33Å; Q162-H165 PolarHBondContact O-N 3.48Å; Q162-H165 VanDerWaalsContact O-N 3.16Å; Q162-Y166 HydrophobicContact CB-CD2 4.11Å; Q162-Y166 HydrophobicContact CB-CE2 4.36Å; Q162-Y166 HydrophobicContact CG-CE2 4.29Å; Q162-Y166 WeakPolarHBondContact O-CB 3.17Å; Q162-Y166 WeakPolarHBondContact O-CD2 3.46Å; Q162-Y166 PolarHBondContact O-N 3.48Å
163	C	97.2	Very high	94	Very high	0 Å²	0	54.3 Å²	54.3	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-60	-45.4	177.3	173.6	0	0	0	0	111.8	W125 C138 P157 T159 R160 H165 Y166 C167	W125-C163 HydrophobicContact CB-CB 3.71Å; C138-C163 HydrophobicContact CB-CB 3.83Å; C138-C163 WeakPolarHBondContact CB-SG 3.45Å; C138-C163 WeakPolarHBondContact SG-CB 3.38Å; C138-C163 CovalentContact SG-SG 2.03Å; C138-C163 PolarHBondContact SG-SG 2.87Å; P157-C163 HydrophobicContact CB-CB 3.89Å; P157-C163 HydrophobicContact CG-CB 4.16Å; T159-C163 PolarHBondContact O-N 2.7Å; T159-C163 VanDerWaalsContact O-N 3.09Å; R160-C163 WeakPolarHBondContact O-CB 3.44Å; R160-C163 PolarHBondContact O-N 2.8Å; R160-C163 VanDerWaalsContact O-N 3.14Å; C163-H165 VanDerWaalsContact C-N 3.26Å; C163-H165 PolarHBondContact O-N 2.84Å; C163-Y166 PolarHBondContact O-N 2.75Å; C163-C167 WeakPolarHBondContact O-CA 3.03Å; C163-C167 WeakPolarHBondContact O-CB 3.29Å; C163-C167 PolarHBondContact O-N 2.8Å; C163-C167 PolarHBondContact O-SG 2.98Å
164	L	96.8	Very high	94.7	Very high	81 Å²	81	55.7 Å²	55.7	42%	0.424	26%	0.261	S	S	.	.	H	α-helix	trans	-62.6	-33.4	176.7	-68.3	170.9	0	0	0	112.8	C138 R160 Q161 Q162 Y168	C138-L164 PolarHBondContact SG-N 3.3Å; R160-L164 HydrophobicContact CG-CD1 4.38Å; R160-L164 WeakPolarHBondContact O-CG 3.33Å; R160-L164 PolarHBondContact O-N 3.14Å; Q161-L164 PolarHBondContact O-N 3.22Å; Q162-L164 VanDerWaalsContact C-N 3.35Å; Q162-L164 PolarHBondContact O-N 3.33Å; L164-Y168 HydrophobicContact CD2-CD2 4.28Å; L164-Y168 HydrophobicContact CD2-CE2 4.12Å
165	H	95.4	Very high	95.2	Very high	102 Å²	102	58.6 Å²	58.6	47%	0.472	28%	0.275	S	S	.	.	H	α-helix	trans	-78.2	-41.3	-179.8	179.8	-93.3	0	0	0	113.3	R65 Q161 Q162 C163	R65-H165 PolarHBondContact NE-O 3.43Å; Q161-H165 WeakPolarHBondContact O-CB 3.41Å; Q161-H165 PolarHBondContact O-N 2.89Å; Q162-H165 PolarHBondContact O-N 3.48Å; Q162-H165 VanDerWaalsContact O-N 3.16Å; C163-H165 VanDerWaalsContact C-N 3.26Å; C163-H165 PolarHBondContact O-N 2.84Å
166	Y	95.2	Very high	95.6	Very high	74 Å²	74	61.3 Å²	61.3	29%	0.29	29%	0.285	S	S	.	.	H	α-helix	trans	-98.2	-15.2	-171.6	-69.2	-73.5	0	0	0	114	R65 P86 C90 Q162 C163	R65-Y166 VanDerWaalsContact CB-O 3.3Å; R65-Y166 WeakPolarHBondContact CB-O 3.35Å; R65-Y166 PolarHBondContact N-O 3Å; P86-Y166 HydrophobicContact CG-CD1 4Å; P86-Y166 HydrophobicContact CG-CD2 3.27Å; P86-Y166 HydrophobicContact CG-CE1 4.17Å; P86-Y166 HydrophobicContact CG-CE2 3.48Å; P86-Y166 VanDerWaalsContact CG-CE2 3.48Å; P86-Y166 HydrophobicContact CG-CG 3.56Å; C90-Y166 PolarHBondContact SG-O 2.87Å; Q162-Y166 HydrophobicContact CB-CD2 4.11Å; Q162-Y166 HydrophobicContact CB-CE2 4.36Å; Q162-Y166 HydrophobicContact CG-CE2 4.29Å; Q162-Y166 WeakPolarHBondContact O-CB 3.17Å; Q162-Y166 WeakPolarHBondContact O-CD2 3.46Å; Q162-Y166 PolarHBondContact O-N 3.48Å; C163-Y166 PolarHBondContact O-N 2.75Å
167	C	94.8	Very high	95.9	Very high	1 Å²	1	66.1 Å²	66.1	1%	0.007	31%	0.306	C	S	.	.			trans	-110.9	-4.1	-175.8	-47.4	0	0	0	0	114.2	L63 C90 R127 C163	L63-C167 CarbonylContact O-C 3.57Å; C90-C167 WeakPolarHBondContact CA-SG 3.41Å; C90-C167 HydrophobicContact CB-CB 3.62Å; C90-C167 WeakPolarHBondContact CB-SG 3.35Å; C90-C167 WeakPolarHBondContact SG-CA 3.28Å; C90-C167 WeakPolarHBondContact SG-CB 3.45Å; C90-C167 CovalentContact SG-SG 2.03Å; C90-C167 PolarHBondContact SG-SG 2.69Å; R127-C167 HydrophobicContact CB-CB 3.71Å; R127-C167 WeakPolarHBondContact CD-O 3.16Å; R127-C167 HydrophobicContact CG-CB 4.47Å; R127-C167 PolarHBondContact NH1-O 2.83Å; C163-C167 WeakPolarHBondContact O-CA 3.03Å; C163-C167 WeakPolarHBondContact O-CB 3.29Å; C163-C167 PolarHBondContact O-N 2.8Å; C163-C167 PolarHBondContact O-SG 2.98Å
168	Y	92.6	Very high	95.9	Very high	88 Å²	88	72.1 Å²	72.1	35%	0.345	33%	0.333	S	S	.	.			trans	-124.9	0	176	-68.8	-97.1	0	0	0	109.4	R65 R127 D136 E137 L164	R65-Y168 PolarHBondContact NE-OXT 2.92Å; R65-Y168 PolarHBondContact NH2-OXT 2.99Å; R127-Y168 HydrophobicContact CG-CE2 4.04Å; D136-Y168 PolarHBondContact O-OH 3.4Å; D136-Y168 WeakPolarHBondContact OD1-CE1 3.46Å; D136-Y168 PolarHBondContact OD1-OH 3.3Å; E137-Y168 VanDerWaalsContact C-OH 3.31Å; E137-Y168 WeakPolarHBondContact CA-OH 3.36Å; E137-Y168 PolarHBondContact N-OH 2.92Å; E137-Y168 VanDerWaalsContact N-OH 3.08Å; L164-Y168 HydrophobicContact CD2-CD2 4.28Å; L164-Y168 HydrophobicContact CD2-CE2 4.12Å

Retrieved 168 of 168 residues in 29.8 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).