G4V7F1_SCHMA Loading...

PINc domain-containing protein

AlphaFold DB , UniProt , Accession G4V7F1, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 198 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	50.2	Low	79.1	Confident	245 Å²	245	174.9 Å²	174.9	100%	1.207	89%	0.889	S	S	*	*				0	114.6	0	-72.8	-173.7	170.8	0	0	109.2
2	G	71.7	Confident	79.6	Confident	80 Å²	80	168.1 Å²	168.1	83%	0.825	88%	0.879	S	S	*	*	P	Polyproline II helix	trans	-79.6	133.1	177.5	0	0	0	0	0	111.3	A4	G2-A4 PolarHBondContact O-N 3.32Å
3	K	76.8	Confident	80.2	Confident	208 Å²	208	168 Å²	168	90%	0.904	88%	0.875	S	S	*	*	P	Polyproline II helix	trans	-57.9	133	178.3	-76.6	179.9	176.3	176.5	0	110.5	R5	K3-R5 PolarHBondContact O-N 3.43Å
4	A	76.4	Confident	80.8	Confident	102 Å²	102	169.4 Å²	169.4	84%	0.843	87%	0.87	S	S	*	*	P	Polyproline II helix	trans	-57.2	127.3	172.7	0	0	0	0	0	110.1	G2	G2-A4 PolarHBondContact O-N 3.32Å
5	R	81.1	Confident	81.2	Confident	239 Å²	239	174.5 Å²	174.5	90%	0.902	87%	0.874	S	S	*	*	P	Polyproline II helix	trans	-69.3	135.6	176.3	-76.7	-178.2	168.9	-177.8	-3.1	109.5	K3 T7	K3-R5 PolarHBondContact O-N 3.43Å; R5-T7 PolarHBondContact O-N 3.33Å
6	Q	83.5	Confident	81.6	Confident	193 Å²	193	174.1 Å²	174.1	90%	0.902	87%	0.871	S	S	*	*	P	Polyproline II helix	trans	-57.8	129.8	172.4	-78.3	-176.8	-8.3	0	0	110.3
7	T	85.2	Confident	81.7	Confident	135 Å²	135	170.2 Å²	170.2	83%	0.828	85%	0.853	S	S	*	*	P	Polyproline II helix	trans	-65.1	131.8	175.7	48.6	0	0	0	0	110.1	R5	R5-T7 PolarHBondContact O-N 3.33Å
8	R	85.3	Confident	81.7	Confident	238 Å²	238	163.9 Å²	163.9	90%	0.898	83%	0.827	S	S	*	*	P	Polyproline II helix	trans	-63.8	142.1	175.2	-66.7	-179.3	178.9	176.2	-0.9	109.8
9	K	87.3	Confident	81.5	Confident	189 Å²	189	162.4 Å²	162.4	82%	0.822	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-70.3	134.5	174	-66.4	-173.4	177.3	-174.9	0	110
10	F	88.3	Confident	81.3	Confident	204 Å²	204	159.8 Å²	159.8	90%	0.895	81%	0.813	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.2	148.3	167.5	-71.6	-84.6	0	0	0	110.3	A12	F10-A12 PolarHBondContact O-N 3.13Å
11	A	84.7	Confident	81.4	Confident	91 Å²	91	153.5 Å²	153.5	75%	0.752	78%	0.782	S	S	*	*	T	Hydrogen-bonded Turn	trans	58.1	34.9	178.3	0	0	0	0	0	116.3	M13	A11-M13 PolarHBondContact O-N 3.37Å; A11-M13 VanDerWaalsContact O-N 3.13Å
12	A	84.5	Confident	83	Confident	93 Å²	93	147.2 Å²	147.2	77%	0.769	76%	0.762	S	S	*	*			trans	-66.9	109.8	169.8	0	0	0	0	0	110.9	F10	F10-A12 PolarHBondContact O-N 3.13Å
13	M	87.5	Confident	83.5	Confident	167 Å²	167	152.4 Å²	152.4	82%	0.823	76%	0.757	S	S	*	*			trans	-99	155.3	176.1	-63.6	-176.9	-179.7	0	0	111.9	A11 R15	A11-M13 PolarHBondContact O-N 3.37Å; A11-M13 VanDerWaalsContact O-N 3.13Å; M13-R15 PolarHBondContact O-N 3.12Å
14	K	89.4	Confident	83.6	Confident	187 Å²	187	144.7 Å²	144.7	81%	0.813	73%	0.725	S	S	*	*			trans	-62.1	128.6	169.6	-175.9	176.1	-179.1	178.9	0	109	M16	K14-M16 PolarHBondContact O-N 3.4Å; K14-M16 VanDerWaalsContact O-N 3.12Å
15	R	87.1	Confident	83.7	Confident	247 Å²	247	147.3 Å²	147.3	93%	0.932	72%	0.718	S	S	*	*			trans	-62.8	114.8	176.8	-65.4	-178.6	-177.8	167.2	-0.1	109.4	M13	M13-R15 PolarHBondContact O-N 3.12Å
16	M	86.6	Confident	83.4	Confident	167 Å²	167	144 Å²	144	82%	0.823	71%	0.71	S	S	*	*			trans	-108.1	151.1	170.7	-67	-171.9	-75	0	0	109.2	K14 S18	K14-M16 PolarHBondContact O-N 3.4Å; K14-M16 VanDerWaalsContact O-N 3.12Å; M16-S18 PolarHBondContact O-N 3.36Å
17	I	83.5	Confident	82.9	Confident	109 Å²	109	143.6 Å²	143.6	56%	0.559	71%	0.705	S	S	*	*			trans	-62.8	128.4	173.8	-69.1	172.4	0	0	0	108.1	D21 I24	I17-D21 HydrophobicContact CG2-CB 3.62Å; I17-I24 HydrophobicContact CG2-CD1 3.63Å; I17-I24 HydrophobicContact CG2-CG1 4.1Å
18	S	81.2	Confident	82.2	Confident	57 Å²	57	143 Å²	143	40%	0.399	70%	0.696	S	S	.	*			trans	-72.5	148.6	176.5	69.1	0	0	0	0	110.2	M16 T20 D21 I24	M16-S18 PolarHBondContact O-N 3.36Å; S18-T20 PolarHBondContact O-N 3.02Å; S18-T20 PolarHBondContact OG-OG1 3Å; S18-D21 VanDerWaalsContact O-CB 3.25Å; S18-D21 WeakPolarHBondContact O-CB 3.44Å; S18-D21 PolarHBondContact O-N 2.73Å; S18-D21 PolarHBondContact OG-N 3.31Å; S18-D21 VanDerWaalsContact OG-N 3.15Å; S18-I24 WeakPolarHBondContact O-CD1 3.25Å
19	L	77.6	Confident	81.2	Confident	135 Å²	135	135.2 Å²	135.2	71%	0.707	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.3	-16.7	170.9	-66.5	171.8	0	0	0	112.4	R29	L19-R29 WeakPolarHBondContact O-CD 3.08Å; L19-R29 VanDerWaalsContact O-CZ 3.29Å; L19-R29 PolarHBondContact O-NE 3.5Å; L19-R29 VanDerWaalsContact O-NE 3.11Å; L19-R29 PolarHBondContact O-NH1 3.32Å
20	T	78.9	Confident	80	Confident	109 Å²	109	132.6 Å²	132.6	67%	0.669	66%	0.661	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.5	-7.2	177.8	52.4	0	0	0	0	114.2	S18 S22 R29	S18-T20 PolarHBondContact O-N 3.02Å; S18-T20 PolarHBondContact OG-OG1 3Å; T20-S22 PolarHBondContact O-N 3.15Å; T20-R29 PolarHBondContact O-NH1 3.37Å; T20-R29 PolarHBondContact O-NH2 3.31Å
21	D	83.5	Confident	78.7	Confident	28 Å²	28	131.7 Å²	131.7	15%	0.15	66%	0.657	C	S	.	*			trans	-61.1	125.8	-175.5	-169.7	-44.9	0	0	0	111.6	I17 S18 R23 I24 R29	I17-D21 HydrophobicContact CG2-CB 3.62Å; S18-D21 VanDerWaalsContact O-CB 3.25Å; S18-D21 WeakPolarHBondContact O-CB 3.44Å; S18-D21 PolarHBondContact O-N 2.73Å; S18-D21 PolarHBondContact OG-N 3.31Å; S18-D21 VanDerWaalsContact OG-N 3.15Å; D21-R23 PolarHBondContact O-N 3.02Å; D21-R23 WeakPolarHBondContact OD1-CB 3.46Å; D21-R23 WeakPolarHBondContact OD1-CG 3.39Å; D21-R23 IonicContact OD1-CZ 3.31Å; D21-R23 PolarHBondContact OD1-N 3.01Å; D21-R23 IonicContact OD1-NE 3.43Å; D21-R23 PolarHBondContact OD1-NE 2.94Å; D21-R23 IonicContact OD1-NH2 3.86Å; D21-R23 IonicContact OD2-CZ 3.89Å; D21-R23 IonicContact OD2-NE 2.74Å; D21-R23 PolarHBondContact OD2-NE 2.92Å; D21-R23 IonicContact OD2-NH2 2.73Å; D21-R23 PolarHBondContact OD2-NH2 3.29Å; D21-I24 PolarHBondContact O-N 3.43Å; D21-R29 PolarHBondContact O-NH2 3.42Å
22	S	82.6	Confident	77.3	Confident	114 Å²	114	137.7 Å²	137.7	80%	0.797	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54.2	-20	-176.1	52.4	0	0	0	0	114	T20	T20-S22 PolarHBondContact O-N 3.15Å
23	R	82.5	Confident	75.9	Confident	188 Å²	188	138.4 Å²	138.4	71%	0.709	66%	0.661	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.3	-25.1	175.7	-66	175.2	-77.3	-176.1	-4.2	114.1	D21 K25	D21-R23 PolarHBondContact O-N 3.02Å; D21-R23 WeakPolarHBondContact OD1-CB 3.46Å; D21-R23 WeakPolarHBondContact OD1-CG 3.39Å; D21-R23 IonicContact OD1-CZ 3.31Å; D21-R23 PolarHBondContact OD1-N 3.01Å; D21-R23 IonicContact OD1-NE 3.43Å; D21-R23 PolarHBondContact OD1-NE 2.94Å; D21-R23 IonicContact OD1-NH2 3.86Å; D21-R23 IonicContact OD2-CZ 3.89Å; D21-R23 IonicContact OD2-NE 2.74Å; D21-R23 PolarHBondContact OD2-NE 2.92Å; D21-R23 IonicContact OD2-NH2 2.73Å; D21-R23 PolarHBondContact OD2-NH2 3.29Å; R23-K25 PolarHBondContact O-N 3.36Å
24	I	79.2	Confident	74.2	Confident	47 Å²	47	135.5 Å²	135.5	24%	0.241	65%	0.653	C	S	.	*	S	Bend	trans	-84.5	115.6	176	-52.8	174.6	0	0	0	108.6	I17 S18 D21 K26 D28 R29	I17-I24 HydrophobicContact CG2-CD1 3.63Å; I17-I24 HydrophobicContact CG2-CG1 4.1Å; S18-I24 WeakPolarHBondContact O-CD1 3.25Å; D21-I24 PolarHBondContact O-N 3.43Å; I24-K26 PolarHBondContact O-N 3.11Å; I24-D28 HydrophobicContact CG2-CB 4.25Å; I24-R29 HydrophobicContact CB-CG 4.06Å; I24-R29 HydrophobicContact CG2-CG 3.47Å; I24-R29 VanDerWaalsContact CG2-CG 3.47Å; I24-R29 PolarHBondContact O-NE 2.92Å; I24-R29 PolarHBondContact O-NH2 2.88Å
25	K	79.3	Confident	72.2	Confident	157 Å²	157	132.3 Å²	132.3	68%	0.683	65%	0.651	S	S	*	*			trans	-57.7	136.3	174.2	-68	177.3	-179	173.5	0	109.3	R23 K27 D28 R29	R23-K25 PolarHBondContact O-N 3.36Å; K25-K27 PolarHBondContact O-N 2.94Å; K25-D28 PolarHBondContact O-N 2.63Å; K25-R29 PolarHBondContact O-N 3.44Å
26	K	74.3	Confident	70.1	Confident	170 Å²	170	128.9 Å²	128.9	74%	0.739	64%	0.643	S	S	*	*	H	α-helix	trans	-50.9	-31.5	179.2	-71.8	-177.6	178.1	179.4	0	113.5	I24 D28 R29	I24-K26 PolarHBondContact O-N 3.11Å; K26-D28 VanDerWaalsContact C-N 3.29Å; K26-D28 PolarHBondContact O-N 2.81Å; K26-R29 PolarHBondContact O-N 3.37Å
27	K	73	Confident	68.2	Low	184 Å²	184	129.8 Å²	129.8	80%	0.8	64%	0.643	S	S	*	*	H	α-helix	trans	-64.2	-30.3	177.4	-62.7	-173	179.5	-176.5	0	113.6	K25	K25-K27 PolarHBondContact O-N 2.94Å
28	D	69.3	Low	66.4	Low	121 Å²	121	132.7 Å²	132.7	65%	0.647	65%	0.654	S	S	*	*	H	α-helix	trans	-93.8	-16.8	-178.7	-53.6	-35.4	0	0	0	112	I24 K25 K26	I24-D28 HydrophobicContact CG2-CB 4.25Å; K25-D28 PolarHBondContact O-N 2.63Å; K26-D28 VanDerWaalsContact C-N 3.29Å; K26-D28 PolarHBondContact O-N 2.81Å
29	R	64.9	Low	64.5	Low	76 Å²	76	136 Å²	136	29%	0.287	67%	0.667	S	S	.	*	H	α-helix	trans	-73	-33.9	175.2	-64.6	-179.4	-176.1	-162.1	-2.2	112.9	L19 T20 D21 I24 K25 K26 K31	L19-R29 WeakPolarHBondContact O-CD 3.08Å; L19-R29 VanDerWaalsContact O-CZ 3.29Å; L19-R29 PolarHBondContact O-NE 3.5Å; L19-R29 VanDerWaalsContact O-NE 3.11Å; L19-R29 PolarHBondContact O-NH1 3.32Å; T20-R29 PolarHBondContact O-NH1 3.37Å; T20-R29 PolarHBondContact O-NH2 3.31Å; D21-R29 PolarHBondContact O-NH2 3.42Å; I24-R29 HydrophobicContact CB-CG 4.06Å; I24-R29 HydrophobicContact CG2-CG 3.47Å; I24-R29 VanDerWaalsContact CG2-CG 3.47Å; I24-R29 PolarHBondContact O-NE 2.92Å; I24-R29 PolarHBondContact O-NH2 2.88Å; K25-R29 PolarHBondContact O-N 3.44Å; K26-R29 PolarHBondContact O-N 3.37Å; R29-K31 PolarHBondContact O-N 2.99Å
30	L	63.2	Low	63	Low	133 Å²	133	136.3 Å²	136.3	70%	0.696	67%	0.674	S	S	*	*	S	Bend	trans	-77.4	111.9	178.6	-67.2	161.8	0	0	0	106.7	K32	L30-K32 PolarHBondContact O-N 3.46Å
31	K	59.5	Low	61.6	Low	186 Å²	186	134.3 Å²	134.3	81%	0.809	67%	0.665	S	S	*	*			trans	-45.7	138.2	155.7	-76.2	-179.3	177.9	179.3	0	105.8	R29 V33	R29-K31 PolarHBondContact O-N 2.99Å; K31-V33 HydrophobicContact CB-CG2 4.32Å; K31-V33 PolarHBondContact O-N 3.22Å
32	K	56.4	Low	60.1	Low	217 Å²	217	142.9 Å²	142.9	94%	0.943	70%	0.704	S	S	*	*			trans	-62.1	69.2	172.4	-72.8	-179.6	179.4	176.8	0	109.3	L30 T34	L30-K32 PolarHBondContact O-N 3.46Å; K32-T34 PolarHBondContact O-N 2.59Å
33	V	54.8	Low	58.9	Low	107 Å²	107	144.6 Å²	144.6	65%	0.648	70%	0.699	S	S	*	*			trans	-69.3	109.6	159.9	-174.9	0	0	0	0	101.4	K31	K31-V33 HydrophobicContact CB-CG2 4.32Å; K31-V33 PolarHBondContact O-N 3.22Å
34	T	52.4	Low	57.8	Low	107 Å²	107	143.8 Å²	143.8	66%	0.656	71%	0.705	S	S	*	*			trans	-33.6	126.3	161.4	40	0	0	0	0	107.6	K32 F36	K32-T34 PolarHBondContact O-N 2.59Å; T34-F36 PolarHBondContact O-N 2.79Å
35	P	46.4	Very low	57.1	Low	120 Å²	120	146.2 Å²	146.2	78%	0.779	73%	0.726	S	S	*	*			trans	-61.9	91.6	-170.2	25.1	-33.2	0	0	0	109.3	K37	P35-K37 VanDerWaalsContact C-N 3.29Å; P35-K37 PolarHBondContact O-N 2.63Å; P35-K37 VanDerWaalsContact O-N 3.12Å
36	F	43.1	Very low	56.6	Low	175 Å²	175	144.3 Å²	144.3	77%	0.768	73%	0.728	S	S	*	*			trans	-66.8	103.7	150.5	-106	-86.3	0	0	0	103	T34 Q38	T34-F36 PolarHBondContact O-N 2.79Å; F36-Q38 VanDerWaalsContact C-N 3.26Å; F36-Q38 PolarHBondContact O-N 3.12Å
37	K	45.7	Very low	56.7	Low	186 Å²	186	144.8 Å²	144.8	81%	0.809	73%	0.73	S	S	*	*			trans	-54.3	96.4	171.4	-67.2	175.8	177	179.6	0	106.9	P35	P35-K37 VanDerWaalsContact C-N 3.29Å; P35-K37 PolarHBondContact O-N 2.63Å; P35-K37 VanDerWaalsContact O-N 3.12Å
38	Q	46.8	Very low	56.7	Low	170 Å²	170	143.4 Å²	143.4	79%	0.794	73%	0.726	S	S	*	*			trans	-86.8	107.7	163.1	-77.6	-177.8	-14	0	0	105	F36 T40	F36-Q38 VanDerWaalsContact C-N 3.26Å; F36-Q38 PolarHBondContact O-N 3.12Å; Q38-T40 PolarHBondContact O-N 2.88Å
39	D	42.2	Very low	56.9	Low	126 Å²	126	144 Å²	144	67%	0.674	73%	0.729	S	S	*	*			trans	-60.9	90.1	-176.3	-65.4	-44	0	0	0	110.5	S41	D39-S41 VanDerWaalsContact C-N 3.25Å; D39-S41 PolarHBondContact O-N 2.73Å
40	T	46.1	Very low	57.4	Low	141 Å²	141	145.2 Å²	145.2	87%	0.865	75%	0.747	S	S	*	*			trans	-91.6	63.8	164.1	56.8	0	0	0	0	109.2	Q38	Q38-T40 PolarHBondContact O-N 2.88Å
41	S	49	Very low	57.9	Low	67 Å²	67	147.1 Å²	147.1	47%	0.469	75%	0.752	S	S	.	*	S	Bend	trans	-169.3	141.4	155.8	61	0	0	0	0	107.8	D39 H43	D39-S41 VanDerWaalsContact C-N 3.25Å; D39-S41 PolarHBondContact O-N 2.73Å; S41-H43 PolarHBondContact O-N 3.35Å; S41-H43 PolarHBondContact OG-CD2 3.23Å; S41-H43 VanDerWaalsContact OG-CD2 3.23Å
42	H	51.9	Low	58.5	Low	208 Å²	208	144 Å²	144	96%	0.963	75%	0.748	S	S	*	*			trans	-65.4	33.8	175.6	-77.4	-88.1	0	0	0	113.5
43	H	57.2	Low	59.3	Low	151 Å²	151	137.4 Å²	137.4	70%	0.699	72%	0.72	S	S	*	*			trans	-81.6	123.1	173.8	-79.6	-96.3	0	0	0	108.9	S41 S45	S41-H43 PolarHBondContact O-N 3.35Å; S41-H43 PolarHBondContact OG-CD2 3.23Å; S41-H43 VanDerWaalsContact OG-CD2 3.23Å; H43-S45 PolarHBondContact O-N 3.09Å
44	M	58.6	Low	60.2	Low	170 Å²	170	138.5 Å²	138.5	84%	0.837	73%	0.729	S	S	*	*			trans	-43.8	124.7	170.9	-69.2	168.9	63.7	0	0	109.7	V46	M44-V46 PolarHBondContact O-N 3.12Å
45	S	64.3	Low	61.4	Low	98 Å²	98	135 Å²	135	69%	0.685	71%	0.708	S	S	*	*			trans	-67.9	86	173.5	60.3	0	0	0	0	108.8	H43 K47	H43-S45 PolarHBondContact O-N 3.09Å; S45-K47 PolarHBondContact O-N 3.18Å; S45-K47 VanDerWaalsContact O-N 3.09Å
46	V	70.1	Confident	62.9	Low	117 Å²	117	130.8 Å²	130.8	71%	0.709	68%	0.679	S	S	*	*			trans	-71.9	104.8	176.1	-178.4	0	0	0	0	107.7	M44 H48	M44-V46 PolarHBondContact O-N 3.12Å; V46-H48 PolarHBondContact O-N 2.8Å; V46-H48 VanDerWaalsContact O-N 3.12Å
47	K	75.7	Confident	64.2	Low	180 Å²	180	128 Å²	128	78%	0.783	67%	0.667	S	S	*	*			trans	-73	99.7	167.7	-71.5	-178	-178.5	177.4	0	107.9	S45 N49	S45-K47 PolarHBondContact O-N 3.18Å; S45-K47 VanDerWaalsContact O-N 3.09Å; K47-N49 PolarHBondContact O-N 2.82Å
48	H	73.8	Confident	65.2	Low	155 Å²	155	126.8 Å²	126.8	72%	0.718	67%	0.669	S	S	*	*			trans	-76.7	90.5	173.7	-172	-64.3	0	0	0	109.5	V46 P50	V46-H48 PolarHBondContact O-N 2.8Å; V46-H48 VanDerWaalsContact O-N 3.12Å; H48-P50 WeakPolarHBondContact O-CD 3.38Å
49	N	72.9	Confident	66.4	Low	134 Å²	134	122.5 Å²	122.5	72%	0.717	66%	0.658	S	S	*	*	P	Polyproline II helix	trans	-79.1	116.7	165.8	-76.5	-3.2	0	0	0	107.8	K47 E51	K47-N49 PolarHBondContact O-N 2.82Å; N49-E51 PolarHBondContact O-N 3.2Å
50	P	75.2	Confident	67.9	Low	101 Å²	101	119.8 Å²	119.8	66%	0.656	64%	0.639	S	S	*	*	P	Polyproline II helix	trans	-62.3	123.5	176.6	26.4	-32.4	0	0	0	109.1	H48	H48-P50 WeakPolarHBondContact O-CD 3.38Å
51	E	73.4	Confident	69.5	Low	174 Å²	174	113.2 Å²	113.2	81%	0.813	60%	0.598	S	S	*	*	P	Polyproline II helix	trans	-60.4	141.6	175.7	-65.3	178.9	176.4	0	0	110.2	N49 F53	N49-E51 PolarHBondContact O-N 3.2Å; E51-F53 PolarHBondContact O-N 3.04Å
52	V	71.7	Confident	70.8	Confident	120 Å²	120	114.8 Å²	114.8	73%	0.727	60%	0.598	S	S	*	*	P	Polyproline II helix	trans	-71.2	130.8	173.2	-176.9	0	0	0	0	107.6
53	F	74.6	Confident	72.2	Confident	79 Å²	79	108.3 Å²	108.3	35%	0.346	58%	0.581	S	S	.	*	P	Polyproline II helix	trans	-66.2	128.4	-179	-73.4	-100.8	0	0	0	109.9	E51 C55 L56	E51-F53 PolarHBondContact O-N 3.04Å; F53-C55 PolarHBondContact O-N 3.37Å; F53-C55 VanDerWaalsContact O-N 3.08Å; F53-L56 WeakPolarHBondContact O-CB 3.44Å; F53-L56 PolarHBondContact O-N 2.86Å
54	P	73.1	Confident	73.5	Confident	129 Å²	129	102 Å²	102	84%	0.838	55%	0.552	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.4	-26.1	-176.1	-26.5	33.8	0	0	0	114.5	L56	P54-L56 PolarHBondContact O-N 3.42Å
55	C	77.4	Confident	74.6	Confident	33 Å²	33	95.5 Å²	95.5	22%	0.223	53%	0.529	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.3	-8.3	-179.5	58.9	0	0	0	0	114.5	F53 N61 E62 A63	F53-C55 PolarHBondContact O-N 3.37Å; F53-C55 VanDerWaalsContact O-N 3.08Å; C55-N61 WeakPolarHBondContact O-CA 3.23Å; C55-N61 PolarHBondContact SG-OD1 3.42Å; C55-N61 VanDerWaalsContact SG-OD1 3.39Å; C55-E62 PolarHBondContact O-N 2.75Å; C55-A63 HydrophobicContact CB-CB 3.59Å
56	L	77.9	Confident	75.7	Confident	33 Å²	33	94.8 Å²	94.8	17%	0.173	52%	0.522	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	101.8	-174.8	-164.4	79.6	0	0	0	110.9	F53 P54 Y60 N61 T172	F53-L56 WeakPolarHBondContact O-CB 3.44Å; F53-L56 PolarHBondContact O-N 2.86Å; P54-L56 PolarHBondContact O-N 3.42Å; L56-Y60 CarbonylContact C-O 3.5Å; L56-Y60 VanDerWaalsContact CA-O 3.29Å; L56-Y60 WeakPolarHBondContact CA-O 3.5Å; L56-N61 HydrophobicContact CD1-CB 4.38Å; L56-T172 VanDerWaalsContact CD2-OG1 3.29Å; L56-T172 WeakPolarHBondContact CD2-OG1 3.17Å
57	K	70.5	Confident	76.8	Confident	115 Å²	115	91.8 Å²	91.8	50%	0.5	51%	0.505	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	114.1	169.4	-61.5	-163.5	-166	147.4	0	109.6	S59 Y60 E62	K57-S59 PolarHBondContact O-N 3.04Å; K57-S59 VanDerWaalsContact O-N 3.07Å; K57-Y60 PolarHBondContact N-O 3.02Å; K57-Y60 PolarHBondContact O-N 2.9Å; K57-E62 WeakPolarHBondContact CD-OE1 3.31Å; K57-E62 VanDerWaalsContact CE-OE1 3.23Å; K57-E62 WeakPolarHBondContact CE-OE1 3.45Å; K57-E62 WeakPolarHBondContact CE-OE2 3.45Å; K57-E62 HydrophobicContact CG-CG 4.47Å; K57-E62 IonicContact NZ-OE1 2.63Å; K57-E62 PolarHBondContact NZ-OE1 2.7Å; K57-E62 IonicContact NZ-OE2 3.87Å; K57-E62 PolarHBondContact NZ-OE2 2.8Å
58	D	66.4	Low	77.7	Confident	161 Å²	161	84 Å²	84	86%	0.861	47%	0.47	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.9	41.8	173.2	-55.9	-33.9	0	0	0	114.7
59	S	72.8	Confident	78.7	Confident	81 Å²	81	79.5 Å²	79.5	57%	0.566	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	83	-12.4	-175.9	81.3	0	0	0	0	117.4	K57 G173	K57-S59 PolarHBondContact O-N 3.04Å; K57-S59 VanDerWaalsContact O-N 3.07Å; S59-G173 PolarHBondContact O-N 2.89Å
60	Y	72.4	Confident	79.7	Confident	69 Å²	69	73.1 Å²	73.1	27%	0.271	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	141.3	172.2	-176.2	-126.4	0	0	0	111.5	L56 K57 E62 P190	L56-Y60 CarbonylContact C-O 3.5Å; L56-Y60 VanDerWaalsContact CA-O 3.29Å; L56-Y60 WeakPolarHBondContact CA-O 3.5Å; K57-Y60 PolarHBondContact N-O 3.02Å; K57-Y60 PolarHBondContact O-N 2.9Å; Y60-E62 HydrophobicContact CD1-CG 4.04Å; Y60-E62 HydrophobicContact CE1-CG 4.24Å; Y60-P190 HydrophobicContact CD1-CG 4.18Å; Y60-P190 HydrophobicContact CD2-CB 4.47Å; Y60-P190 HydrophobicContact CD2-CG 3.21Å; Y60-P190 HydrophobicContact CE1-CG 3.93Å; Y60-P190 HydrophobicContact CE2-CB 4.45Å; Y60-P190 HydrophobicContact CE2-CG 2.97Å; Y60-P190 HydrophobicContact CG-CG 3.83Å
61	N	80.3	Confident	80.7	Confident	2 Å²	2	68.3 Å²	68.3	1%	0.011	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	103.3	179.3	-179.3	4.1	0	0	0	109	C55 L56 A63 L64 R153 G173	C55-N61 WeakPolarHBondContact O-CA 3.23Å; C55-N61 PolarHBondContact SG-OD1 3.42Å; C55-N61 VanDerWaalsContact SG-OD1 3.39Å; L56-N61 HydrophobicContact CD1-CB 4.38Å; N61-A63 PolarHBondContact O-N 3.39Å; N61-A63 WeakPolarHBondContact OD1-CB 3.44Å; N61-A63 PolarHBondContact OD1-N 2.75Å; N61-L64 HydrophobicContact CB-CD1 4.03Å; N61-L64 HydrophobicContact CB-CG 4.47Å; N61-L64 VanDerWaalsContact ND2-CD1 3.3Å; N61-L64 WeakPolarHBondContact ND2-CD1 3.46Å; N61-L64 WeakPolarHBondContact ND2-CG 3.26Å; N61-L64 PolarHBondContact O-N 3.17Å; N61-R153 PolarHBondContact ND2-O 3.25Å; N61-G173 PolarHBondContact ND2-O 2.83Å; N61-G173 VanDerWaalsContact ND2-O 3.11Å
62	E	75.9	Confident	81.8	Confident	100 Å²	100	60 Å²	60	47%	0.467	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.9	-17.8	-178.4	-63.8	-172.8	155	0	0	113	C55 K57 Y60 L64	C55-E62 PolarHBondContact O-N 2.75Å; K57-E62 WeakPolarHBondContact CD-OE1 3.31Å; K57-E62 VanDerWaalsContact CE-OE1 3.23Å; K57-E62 WeakPolarHBondContact CE-OE1 3.45Å; K57-E62 WeakPolarHBondContact CE-OE2 3.45Å; K57-E62 HydrophobicContact CG-CG 4.47Å; K57-E62 IonicContact NZ-OE1 2.63Å; K57-E62 PolarHBondContact NZ-OE1 2.7Å; K57-E62 IonicContact NZ-OE2 3.87Å; K57-E62 PolarHBondContact NZ-OE2 2.8Å; Y60-E62 HydrophobicContact CD1-CG 4.04Å; Y60-E62 HydrophobicContact CE1-CG 4.24Å; E62-L64 VanDerWaalsContact C-N 3.28Å; E62-L64 PolarHBondContact O-N 3.41Å
63	A	81.2	Confident	82.9	Confident	73 Å²	73	54.4 Å²	54.4	60%	0.603	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.5	-12.3	-179.3	0	0	0	0	0	113.2	C55 N61 G65	C55-A63 HydrophobicContact CB-CB 3.59Å; N61-A63 PolarHBondContact O-N 3.39Å; N61-A63 WeakPolarHBondContact OD1-CB 3.44Å; N61-A63 PolarHBondContact OD1-N 2.75Å; A63-G65 PolarHBondContact O-N 2.93Å
64	L	84.6	Confident	83.8	Confident	18 Å²	18	50.9 Å²	50.9	9%	0.094	30%	0.296	C	S	.	.			trans	-80.3	101.4	175.4	-77.7	167.3	0	0	0	109.8	N61 E62 G173 P175	N61-L64 HydrophobicContact CB-CD1 4.03Å; N61-L64 HydrophobicContact CB-CG 4.47Å; N61-L64 VanDerWaalsContact ND2-CD1 3.3Å; N61-L64 WeakPolarHBondContact ND2-CD1 3.46Å; N61-L64 WeakPolarHBondContact ND2-CG 3.26Å; N61-L64 PolarHBondContact O-N 3.17Å; E62-L64 VanDerWaalsContact C-N 3.28Å; E62-L64 PolarHBondContact O-N 3.41Å; L64-G173 WeakPolarHBondContact CD1-O 3.33Å; L64-P175 VanDerWaalsContact CD1-CD 3.43Å; L64-P175 HydrophobicContact CD1-CG 3.69Å
65	G	83.4	Confident	84.7	Confident	33 Å²	33	47.4 Å²	47.4	34%	0.34	27%	0.271	S	S	.	.			trans	-135.1	171.7	172.5	0	0	0	0	0	112.1	A63 P67	A63-G65 PolarHBondContact O-N 2.93Å; G65-P67 CarbonylContact O-C 3.4Å
66	P	87.5	Confident	85.6	Confident	84 Å²	84	45.8 Å²	45.8	55%	0.545	26%	0.26	S	S	.	.	S	Bend	trans	-60.4	138.8	171.5	-23.8	35.3	0	0	0	112	Y68 A97	P66-Y68 HydrophobicContact CG-CE2 3.92Å; P66-A97 HydrophobicContact CB-CB 3.99Å; P66-A97 HydrophobicContact CG-CB 3.74Å
67	P	92.5	Very high	86.4	Confident	53 Å²	53	44.2 Å²	44.2	34%	0.344	25%	0.252	S	S	.	.	S	Bend	cis	-75.9	134.2	-0.5	31.7	-34.4	0	0	0	112.5	G65 H69 K98 F100	G65-P67 CarbonylContact O-C 3.4Å; P67-H69 PolarHBondContact O-CD2 3.38Å; P67-K98 CarbonylContact C-O 3.59Å; P67-K98 VanDerWaalsContact CA-O 3.29Å; P67-K98 WeakPolarHBondContact CA-O 3.36Å; P67-K98 HydrophobicContact CB-CB 4.39Å; P67-K98 HydrophobicContact CB-CG 4.38Å; P67-F100 HydrophobicContact CB-CD2 3.82Å; P67-F100 HydrophobicContact CB-CE2 3.79Å; P67-F100 HydrophobicContact CG-CD2 4.2Å; P67-F100 HydrophobicContact CG-CE2 3.98Å
68	Y	93.4	Very high	87.4	Confident	16 Å²	16	40.2 Å²	40.2	6%	0.063	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	137.3	179.2	-65.7	-63.4	0	0	0	111.6	P66 L95 A97 K98 C99 F100 I156 M189	P66-Y68 HydrophobicContact CG-CE2 3.92Å; Y68-L95 HydrophobicContact CD2-CB 3.9Å; Y68-L95 HydrophobicContact CD2-CD1 3.79Å; Y68-L95 HydrophobicContact CD2-CD2 4.2Å; Y68-L95 HydrophobicContact CD2-CG 4.19Å; Y68-L95 HydrophobicContact CE2-CB 4.06Å; Y68-L95 HydrophobicContact CE2-CD2 4.2Å; Y68-L95 HydrophobicContact CG-CD1 4.06Å; Y68-A97 HydrophobicContact CD2-CB 3.84Å; Y68-A97 HydrophobicContact CE2-CB 3.56Å; Y68-K98 PolarHBondContact N-O 3.34Å; Y68-C99 CarbonylContact O-C 3.56Å; Y68-C99 WeakPolarHBondContact O-CA 3.35Å; Y68-F100 PolarHBondContact O-N 3.14Å; Y68-I156 HydrophobicContact CD1-CD1 3.88Å; Y68-I156 HydrophobicContact CG-CD1 4.02Å; Y68-M189 HydrophobicContact CE1-CE 3.66Å; Y68-M189 HydrophobicContact CE2-CE 4.11Å; Y68-M189 WeakPolarHBondContact OH-CE 3.25Å
69	H	94.6	Very high	88.7	Confident	62 Å²	62	36.5 Å²	36.5	29%	0.287	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	122.7	175.9	-60.5	-82.4	0	0	0	110.1	P67 Y102 Y155 I156	P67-H69 PolarHBondContact O-CD2 3.38Å; H69-Y102 HydrophobicContact CB-CD2 4.18Å; H69-Y102 HydrophobicContact CB-CE2 3.61Å; H69-Y102 PolarHBondContact CE1-OH 3.46Å; H69-Y102 AromaticContact CG-CE2 3.81Å; H69-Y102 AromaticContact ND1-CE2 3.25Å; H69-Y102 VanDerWaalsContact ND1-CE2 3.25Å; H69-Y102 WeakPolarHBondContact ND1-CE2 3.27Å; H69-Y102 AromaticContact ND1-CZ 3.44Å; H69-Y102 PolarHBondContact ND1-OH 3.31Å; H69-Y155 HydrophobicContact CB-CD1 3.8Å; H69-Y155 HydrophobicContact CB-CE1 4.07Å; H69-Y155 CarbonylContact O-C 3.54Å; H69-Y155 WeakPolarHBondContact O-CA 3.38Å; H69-I156 PolarHBondContact O-N 2.63Å
70	I	95.4	Very high	89.8	Confident	0 Å²	0	32.7 Å²	32.7	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	122.7	-169.2	-58.9	169.2	0	0	0	110.3	L72 T91 L95 C99 F100 L101 Y102 I156 A158 M177	I70-L72 HydrophobicContact CG2-CD2 4.4Å; I70-T91 HydrophobicContact CD1-CG2 3.06Å; I70-L95 HydrophobicContact CD1-CD1 3.73Å; I70-C99 HydrophobicContact CD1-CB 3.88Å; I70-F100 PolarHBondContact N-O 3.4Å; I70-L101 HydrophobicContact CB-CD2 3.81Å; I70-L101 HydrophobicContact CD1-CD2 3.99Å; I70-L101 HydrophobicContact CG1-CD2 4.45Å; I70-L101 HydrophobicContact CG2-CD2 4.06Å; I70-Y102 PolarHBondContact O-N 2.91Å; I70-I156 CarbonylContact C-O 3.56Å; I70-I156 VanDerWaalsContact CA-O 3.3Å; I70-I156 WeakPolarHBondContact CA-O 3.47Å; I70-I156 HydrophobicContact CG1-CB 4.06Å; I70-I156 HydrophobicContact CG1-CD1 4.43Å; I70-I156 HydrophobicContact CG1-CG2 4.49Å; I70-A158 HydrophobicContact CG2-CB 3.82Å; I70-M177 HydrophobicContact CD1-CE 4.17Å; I70-M177 HydrophobicContact CG2-CE 3.66Å
71	L	96.6	Very high	90.8	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	121.8	173.2	-67.1	169.7	0	0	0	109.7	T104 L133 L146 R149 Y155 I156 A158	L71-T104 HydrophobicContact CD2-CG2 4.39Å; L71-L133 HydrophobicContact CD2-CD1 3.6Å; L71-L146 HydrophobicContact CB-CD2 3.94Å; L71-L146 HydrophobicContact CD1-CD2 4.18Å; L71-L146 HydrophobicContact CG-CD2 4.49Å; L71-R149 HydrophobicContact CD1-CB 4.37Å; L71-R149 HydrophobicContact CD1-CG 4.1Å; L71-Y155 HydrophobicContact CD1-CD1 4.15Å; L71-Y155 HydrophobicContact CD1-CD2 3.93Å; L71-Y155 HydrophobicContact CD1-CG 3.65Å; L71-Y155 HydrophobicContact CD2-CD1 4.12Å; L71-Y155 HydrophobicContact CD2-CE1 4.29Å; L71-Y155 HydrophobicContact CD2-CG 4.43Å; L71-Y155 HydrophobicContact CG-CD1 3.8Å; L71-Y155 HydrophobicContact CG-CD2 4.47Å; L71-Y155 HydrophobicContact CG-CE1 4.46Å; L71-Y155 HydrophobicContact CG-CG 3.81Å; L71-I156 PolarHBondContact N-O 3.13Å; L71-A158 WeakPolarHBondContact O-CB 3.35Å; L71-A158 PolarHBondContact O-N 3.23Å
72	L	96.3	Very high	91.4	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	133.6	176.4	-62.6	-179.9	0	0	0	111.2	I70 Y76 I87 L101 Y102 V103 L125 I130 A158	I70-L72 HydrophobicContact CG2-CD2 4.4Å; L72-Y76 HydrophobicContact CD2-CD1 3.96Å; L72-Y76 HydrophobicContact CD2-CE1 4.17Å; L72-I87 HydrophobicContact CD2-CG2 4.17Å; L72-L101 HydrophobicContact CD1-CB 4.15Å; L72-L101 HydrophobicContact CD1-CD1 4.27Å; L72-L101 HydrophobicContact CD2-CD2 4.37Å; L72-L101 HydrophobicContact CG-CB 4.46Å; L72-Y102 PolarHBondContact N-O 2.99Å; L72-V103 HydrophobicContact CB-CG2 4.02Å; L72-V103 HydrophobicContact CD1-CG2 3.99Å; L72-V103 HydrophobicContact CG-CG2 4.49Å; L72-L125 HydrophobicContact CD1-CD2 3.83Å; L72-I130 HydrophobicContact CD1-CD1 4.12Å; L72-I130 HydrophobicContact CD1-CG1 4.39Å; L72-A158 HydrophobicContact CD2-CB 3.89Å
73	D	94.7	Very high	92.2	Very high	1 Å²	1	36.9 Å²	36.9	1%	0.005	21%	0.207	C	C	.	.	P	Polyproline II helix	trans	-100.3	156.8	170.8	-175.6	20	0	0	0	111.3	N75 Y76 V77 L146 A158 T159	D73-N75 VanDerWaalsContact C-N 3.32Å; D73-N75 PolarHBondContact O-N 3.13Å; D73-Y76 PolarHBondContact O-N 2.84Å; D73-V77 PolarHBondContact O-N 2.68Å; D73-L146 HydrophobicContact CB-CD1 4.05Å; D73-A158 WeakPolarHBondContact CB-O 3.38Å; D73-A158 PolarHBondContact N-O 3.24Å; D73-A158 VanDerWaalsContact N-O 3.15Å; D73-T159 WeakPolarHBondContact OD2-CB 3.47Å; D73-T159 PolarHBondContact OD2-OG1 3.45Å
74	T	92.8	Very high	92.7	Very high	5 Å²	5	44.5 Å²	44.5	3%	0.031	22%	0.221	C	C	.	.	H	α-helix	trans	-58.1	-46.3	-178.5	65.5	0	0	0	0	111.1	Y76 V77 N78 V107 E110 I111	T74-Y76 VanDerWaalsContact C-N 3.34Å; T74-Y76 PolarHBondContact O-N 3.31Å; T74-V77 PolarHBondContact O-N 2.88Å; T74-N78 PolarHBondContact O-N 3.12Å; T74-N78 PolarHBondContact O-ND2 2.84Å; T74-V107 HydrophobicContact CG2-CB 4.21Å; T74-V107 HydrophobicContact CG2-CG1 3.63Å; T74-V107 HydrophobicContact CG2-CG2 4.48Å; T74-E110 HydrophobicContact CG2-CB 3.98Å; T74-E110 HydrophobicContact CG2-CG 4.04Å; T74-E110 PolarHBondContact OG1-OE1 3.18Å; T74-I111 HydrophobicContact CG2-CD1 3.83Å; T74-I111 HydrophobicContact CG2-CG1 3.58Å
75	N	92.7	Very high	93.1	Very high	56 Å²	56	45.4 Å²	45.4	30%	0.299	23%	0.225	S	C	.	.	H	α-helix	trans	-62.5	-40.7	-179.6	-75.4	-38.6	0	0	0	112	D73 V77 N78 F79	D73-N75 VanDerWaalsContact C-N 3.32Å; D73-N75 PolarHBondContact O-N 3.13Å; N75-V77 VanDerWaalsContact C-N 3.33Å; N75-V77 PolarHBondContact O-N 3.41Å; N75-N78 WeakPolarHBondContact O-CB 3.46Å; N75-N78 PolarHBondContact O-N 2.64Å; N75-F79 HydrophobicContact CB-CD2 4.49Å; N75-F79 WeakPolarHBondContact O-CD2 3.23Å; N75-F79 PolarHBondContact O-N 3.43Å
76	Y	95.3	Very high	93.6	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-60.7	-44	-178.8	-175.5	-92	0	0	0	112.2	L72 D73 T74 N78 F79 S80 I87 A158 M177 I179 V184	L72-Y76 HydrophobicContact CD2-CD1 3.96Å; L72-Y76 HydrophobicContact CD2-CE1 4.17Å; D73-Y76 PolarHBondContact O-N 2.84Å; T74-Y76 VanDerWaalsContact C-N 3.34Å; T74-Y76 PolarHBondContact O-N 3.31Å; Y76-N78 VanDerWaalsContact C-N 3.32Å; Y76-N78 PolarHBondContact O-N 3.07Å; Y76-F79 PolarHBondContact O-N 3.3Å; Y76-S80 WeakPolarHBondContact O-CB 3.41Å; Y76-S80 PolarHBondContact O-N 3.43Å; Y76-S80 PolarHBondContact O-OG 2.71Å; Y76-I87 HydrophobicContact CE1-CG2 4.21Å; Y76-A158 VanDerWaalsContact CB-O 3.23Å; Y76-A158 WeakPolarHBondContact CB-O 3.5Å; Y76-A158 HydrophobicContact CD1-CB 3.81Å; Y76-A158 HydrophobicContact CD2-CB 3.77Å; Y76-A158 HydrophobicContact CE1-CB 3.97Å; Y76-A158 HydrophobicContact CE2-CB 3.93Å; Y76-A158 HydrophobicContact CG-CB 3.72Å; Y76-M177 HydrophobicContact CE1-CE 4.34Å; Y76-M177 HydrophobicContact CE2-CE 4.35Å; Y76-M177 HydrophobicContact CE2-CG 4.43Å; Y76-M177 WeakPolarHBondContact OH-CE 3.41Å; Y76-I179 HydrophobicContact CD2-CD1 4.29Å; Y76-I179 HydrophobicContact CD2-CG1 4.07Å; Y76-I179 HydrophobicContact CE2-CD1 4.02Å; Y76-I179 HydrophobicContact CE2-CG1 3.56Å; Y76-V184 WeakPolarHBondContact OH-CG2 3.38Å
77	V	94.4	Very high	93.9	Very high	0 Å²	0	44 Å²	44	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-62.5	-42.6	177.2	-179.8	0	0	0	0	110.4	D73 T74 N75 S80 I81 I87 A121 L125	D73-V77 PolarHBondContact O-N 2.68Å; T74-V77 PolarHBondContact O-N 2.88Å; N75-V77 VanDerWaalsContact C-N 3.33Å; N75-V77 PolarHBondContact O-N 3.41Å; V77-S80 WeakPolarHBondContact O-CB 3.29Å; V77-S80 PolarHBondContact O-N 3.37Å; V77-I81 HydrophobicContact CG1-CD1 4.26Å; V77-I81 WeakPolarHBondContact O-CG1 3.42Å; V77-I81 PolarHBondContact O-N 3.34Å; V77-I87 HydrophobicContact CB-CD1 4.34Å; V77-I87 HydrophobicContact CG1-CD1 4.04Å; V77-I87 HydrophobicContact CG2-CD1 4.12Å; V77-A121 HydrophobicContact CG1-CB 3.72Å; V77-L125 HydrophobicContact CG1-CD1 4.39Å; V77-L125 HydrophobicContact CG1-CD2 4.4Å; V77-L125 HydrophobicContact CG1-CG 4.22Å; V77-L125 HydrophobicContact CG2-CD1 4.14Å; V77-L125 HydrophobicContact CG2-CD2 3.52Å; V77-L125 HydrophobicContact CG2-CG 4.1Å
78	N	92.9	Very high	94	Very high	31 Å²	31	42.5 Å²	42.5	17%	0.166	19%	0.194	C	C	.	.	H	α-helix	trans	-64.8	-43.1	179.4	-61.8	-28.9	0	0	0	112.5	T74 N75 Y76 S80 I81 K82 Y118	T74-N78 PolarHBondContact O-N 3.12Å; T74-N78 PolarHBondContact O-ND2 2.84Å; N75-N78 WeakPolarHBondContact O-CB 3.46Å; N75-N78 PolarHBondContact O-N 2.64Å; Y76-N78 VanDerWaalsContact C-N 3.32Å; Y76-N78 PolarHBondContact O-N 3.07Å; N78-S80 VanDerWaalsContact C-N 3.32Å; N78-I81 PolarHBondContact O-N 3.49Å; N78-K82 WeakPolarHBondContact O-CB 3.05Å; N78-K82 PolarHBondContact O-N 3.43Å; N78-Y118 HydrophobicContact CB-CE1 4.21Å; N78-Y118 WeakPolarHBondContact ND2-CE1 3.35Å; N78-Y118 WeakPolarHBondContact OD1-CD1 3.49Å; N78-Y118 WeakPolarHBondContact OD1-CE1 3.38Å
79	F	93.9	Very high	93.9	Very high	82 Å²	82	47.6 Å²	47.6	36%	0.36	22%	0.216	S	C	.	.	H	α-helix	trans	-66.8	-34.7	174.6	-83.5	-77	0	0	0	112.1	N75 Y76 K82 N83 C160 I179	N75-F79 HydrophobicContact CB-CD2 4.49Å; N75-F79 WeakPolarHBondContact O-CD2 3.23Å; N75-F79 PolarHBondContact O-N 3.43Å; Y76-F79 PolarHBondContact O-N 3.3Å; F79-K82 PolarHBondContact O-N 2.86Å; F79-N83 WeakPolarHBondContact O-CB 3.3Å; F79-N83 PolarHBondContact O-N 3.12Å; F79-C160 HydrophobicContact CD2-CB 3.48Å; F79-C160 VanDerWaalsContact CD2-CB 3.48Å; F79-C160 HydrophobicContact CE2-CB 3.85Å; F79-C160 HydrophobicContact CG-CB 4.12Å; F79-I179 HydrophobicContact CB-CD1 3.95Å
80	S	94.5	Very high	93.8	Very high	1 Å²	1	45.3 Å²	45.3	1%	0.007	21%	0.207	C	C	.	.	H	α-helix	trans	-61	-46.1	175	-57.4	0	0	0	0	111.1	Y76 V77 N78 N83 R84 L85 I179	Y76-S80 WeakPolarHBondContact O-CB 3.41Å; Y76-S80 PolarHBondContact O-N 3.43Å; Y76-S80 PolarHBondContact O-OG 2.71Å; V77-S80 WeakPolarHBondContact O-CB 3.29Å; V77-S80 PolarHBondContact O-N 3.37Å; N78-S80 VanDerWaalsContact C-N 3.32Å; S80-N83 PolarHBondContact O-N 3.48Å; S80-R84 PolarHBondContact O-N 3.14Å; S80-R84 VanDerWaalsContact O-N 3.08Å; S80-L85 PolarHBondContact O-N 3.13Å; S80-I179 WeakPolarHBondContact OG-CD1 3.23Å
81	I	93.5	Very high	93.7	Very high	61 Å²	61	45.3 Å²	45.3	31%	0.313	21%	0.207	S	C	.	.	H	α-helix	trans	-63.2	-46.1	176.5	-64.2	164.1	0	0	0	110.8	V77 N78 N83 R84 V120 A121 I124	V77-I81 HydrophobicContact CG1-CD1 4.26Å; V77-I81 WeakPolarHBondContact O-CG1 3.42Å; V77-I81 PolarHBondContact O-N 3.34Å; N78-I81 PolarHBondContact O-N 3.49Å; I81-N83 VanDerWaalsContact C-N 3.27Å; I81-N83 PolarHBondContact O-N 2.83Å; I81-R84 PolarHBondContact O-N 2.95Å; I81-R84 VanDerWaalsContact O-N 3.13Å; I81-V120 HydrophobicContact CD1-CB 4.38Å; I81-V120 HydrophobicContact CD1-CG1 4.19Å; I81-A121 HydrophobicContact CD1-CB 3.62Å; I81-I124 HydrophobicContact CD1-CD1 3.92Å; I81-I124 HydrophobicContact CG1-CD1 3.77Å
82	K	92.9	Very high	93.5	Very high	162 Å²	162	49.7 Å²	49.7	70%	0.704	23%	0.229	S	C	*	.	H	α-helix	trans	-58.3	-39.9	179.8	-173	178.6	179.2	-179.5	0	112.3	N78 F79	N78-K82 WeakPolarHBondContact O-CB 3.05Å; N78-K82 PolarHBondContact O-N 3.43Å; F79-K82 PolarHBondContact O-N 2.86Å
83	N	93.2	Very high	93.2	Very high	36 Å²	36	54.4 Å²	54.4	19%	0.193	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.8	5.5	-178.5	-65.6	-15.1	0	0	0	113.7	F79 S80 I81 L85 I179 G181	F79-N83 WeakPolarHBondContact O-CB 3.3Å; F79-N83 PolarHBondContact O-N 3.12Å; S80-N83 PolarHBondContact O-N 3.48Å; I81-N83 VanDerWaalsContact C-N 3.27Å; I81-N83 PolarHBondContact O-N 2.83Å; N83-L85 VanDerWaalsContact C-N 3.28Å; N83-L85 HydrophobicContact CB-CD1 4.13Å; N83-L85 HydrophobicContact CB-CG 4.09Å; N83-L85 PolarHBondContact O-N 3.01Å; N83-I179 VanDerWaalsContact ND2-CG2 3.31Å; N83-I179 WeakPolarHBondContact ND2-CG2 3.23Å; N83-G181 PolarHBondContact ND2-O 2.78Å
84	R	92.6	Very high	93	Very high	234 Å²	234	55.4 Å²	55.4	88%	0.883	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.1	38.9	-178.2	-53.9	-177.2	-177.9	-166.8	0.1	113.3	S80 I81	S80-R84 PolarHBondContact O-N 3.14Å; S80-R84 VanDerWaalsContact O-N 3.08Å; I81-R84 PolarHBondContact O-N 2.95Å; I81-R84 VanDerWaalsContact O-N 3.13Å
85	L	93	Very high	92.9	Very high	36 Å²	36	55.9 Å²	55.9	19%	0.188	26%	0.263	C	S	.	.			trans	-96	129.5	177.2	-62.7	176	0	0	0	110	S80 N83 I87 I179 H182 V184	S80-L85 PolarHBondContact O-N 3.13Å; N83-L85 VanDerWaalsContact C-N 3.28Å; N83-L85 HydrophobicContact CB-CD1 4.13Å; N83-L85 HydrophobicContact CB-CG 4.09Å; N83-L85 PolarHBondContact O-N 3.01Å; L85-I87 PolarHBondContact O-N 2.9Å; L85-I179 HydrophobicContact CD1-CD1 4.36Å; L85-I179 HydrophobicContact CD1-CG2 3.67Å; L85-H182 WeakPolarHBondContact CD2-O 3.29Å; L85-V184 HydrophobicContact CD1-CG2 4.48Å
86	D	93.3	Very high	92.8	Very high	85 Å²	85	59.6 Å²	59.6	46%	0.455	28%	0.282	S	S	.	.			trans	-73.5	120.6	164.8	176.5	6.9	0	0	0	108.6	F88 K89 S90	D86-F88 VanDerWaalsContact C-N 3.3Å; D86-F88 PolarHBondContact O-N 3.3Å; D86-F88 PolarHBondContact OD1-N 3.22Å; D86-F88 VanDerWaalsContact OD1-N 3.12Å; D86-K89 HydrophobicContact CB-CB 4.04Å; D86-K89 PolarHBondContact O-N 3.43Å; D86-S90 WeakPolarHBondContact O-CB 3.39Å; D86-S90 PolarHBondContact O-N 3.35Å; D86-S90 PolarHBondContact O-OG 3.34Å
87	I	93.8	Very high	92.6	Very high	4 Å²	4	60.7 Å²	60.7	2%	0.021	29%	0.291	C	S	.	.	H	α-helix	trans	-59.9	-42.9	-175.5	-59.5	179.4	0	0	0	110.5	L72 Y76 V77 L85 S90 T91 L101 I124	L72-I87 HydrophobicContact CD2-CG2 4.17Å; Y76-I87 HydrophobicContact CE1-CG2 4.21Å; V77-I87 HydrophobicContact CB-CD1 4.34Å; V77-I87 HydrophobicContact CG1-CD1 4.04Å; V77-I87 HydrophobicContact CG2-CD1 4.12Å; L85-I87 PolarHBondContact O-N 2.9Å; I87-S90 PolarHBondContact O-OG 3.25Å; I87-T91 WeakPolarHBondContact O-CB 3.41Å; I87-T91 PolarHBondContact O-N 2.94Å; I87-T91 VanDerWaalsContact O-N 3.15Å; I87-T91 PolarHBondContact O-OG1 2.88Å; I87-L101 HydrophobicContact CG2-CD1 3.64Å; I87-I124 HydrophobicContact CD1-CG2 3.75Å
88	F	93.3	Very high	92.5	Very high	21 Å²	21	67.3 Å²	67.3	9%	0.092	32%	0.32	C	S	.	.	H	α-helix	trans	-68.2	-52.5	-177.2	-63.1	-85.7	0	0	0	110.7	D86 T91 M92 L101 D127 R129 I130	D86-F88 VanDerWaalsContact C-N 3.3Å; D86-F88 PolarHBondContact O-N 3.3Å; D86-F88 PolarHBondContact OD1-N 3.22Å; D86-F88 VanDerWaalsContact OD1-N 3.12Å; F88-T91 PolarHBondContact O-N 3.17Å; F88-M92 HydrophobicContact CB-CE 4.25Å; F88-M92 WeakPolarHBondContact O-CE 3.4Å; F88-M92 WeakPolarHBondContact O-CG 3.23Å; F88-M92 PolarHBondContact O-N 3.19Å; F88-L101 HydrophobicContact CD1-CD1 3.61Å; F88-L101 HydrophobicContact CD1-CG 4.38Å; F88-L101 HydrophobicContact CE1-CD1 3.61Å; F88-L101 HydrophobicContact CE1-CG 4.34Å; F88-L101 HydrophobicContact CG-CD1 4.23Å; F88-L101 HydrophobicContact CZ-CD1 4.23Å; F88-D127 HydrophobicContact CZ-CB 4.43Å; F88-R129 HydrophobicContact CD1-CB 4.33Å; F88-R129 HydrophobicContact CE1-CB 3.38Å; F88-R129 HydrophobicContact CE1-CG 4.45Å; F88-R129 VanDerWaalsContact CE2-CZ 3.45Å; F88-R129 HydrophobicContact CZ-CB 3.6Å; F88-I130 HydrophobicContact CE1-CD1 4.49Å; F88-I130 HydrophobicContact CE1-CG1 3.96Å; F88-I130 HydrophobicContact CE2-CD1 4.31Å; F88-I130 HydrophobicContact CZ-CD1 3.73Å; F88-I130 HydrophobicContact CZ-CG1 3.61Å
89	K	93.1	Very high	92.6	Very high	122 Å²	122	66.8 Å²	66.8	53%	0.53	32%	0.319	S	S	.	.	H	α-helix	trans	-61.1	-51.5	-179.7	-174.8	178.9	178.2	-179.3	0	111.6	D86 T91 M92 D93	D86-K89 HydrophobicContact CB-CB 4.04Å; D86-K89 PolarHBondContact O-N 3.43Å; K89-T91 VanDerWaalsContact C-N 3.26Å; K89-T91 PolarHBondContact O-N 2.97Å; K89-M92 PolarHBondContact O-N 3.37Å; K89-D93 WeakPolarHBondContact CG-OD2 3.48Å; K89-D93 WeakPolarHBondContact O-CB 3.21Å; K89-D93 PolarHBondContact O-N 3.11Å
90	S	92.7	Very high	92.6	Very high	14 Å²	14	65.9 Å²	65.9	10%	0.098	32%	0.315	C	S	.	.	H	α-helix	trans	-62.6	-32.5	-177.3	62.1	0	0	0	0	113.5	D86 I87 C94	D86-S90 WeakPolarHBondContact O-CB 3.39Å; D86-S90 PolarHBondContact O-N 3.35Å; D86-S90 PolarHBondContact O-OG 3.34Å; I87-S90 PolarHBondContact O-OG 3.25Å; S90-C94 VanDerWaalsContact O-CB 3.29Å; S90-C94 WeakPolarHBondContact O-CB 3.35Å; S90-C94 PolarHBondContact O-N 3.1Å; S90-C94 VanDerWaalsContact O-N 3.09Å
91	T	92.2	Very high	92.8	Very high	1 Å²	1	66 Å²	66	1%	0.006	32%	0.315	C	S	.	.	H	α-helix	trans	-72.2	-43.9	175.9	-59.9	0	0	0	0	111.7	I70 I87 F88 K89 C94 L95 C99 L101 M177	I70-T91 HydrophobicContact CD1-CG2 3.06Å; I87-T91 WeakPolarHBondContact O-CB 3.41Å; I87-T91 PolarHBondContact O-N 2.94Å; I87-T91 VanDerWaalsContact O-N 3.15Å; I87-T91 PolarHBondContact O-OG1 2.88Å; F88-T91 PolarHBondContact O-N 3.17Å; K89-T91 VanDerWaalsContact C-N 3.26Å; K89-T91 PolarHBondContact O-N 2.97Å; T91-C94 PolarHBondContact O-N 3.48Å; T91-L95 HydrophobicContact CG2-CD1 4.28Å; T91-L95 PolarHBondContact O-N 2.89Å; T91-L95 VanDerWaalsContact O-N 3.1Å; T91-C99 HydrophobicContact CG2-CB 3.99Å; T91-L101 HydrophobicContact CG2-CD2 4.21Å; T91-M177 HydrophobicContact CG2-CE 3.89Å; T91-M177 HydrophobicContact CG2-SD 3.99Å
92	M	92.3	Very high	92.9	Very high	91 Å²	91	64 Å²	64	45%	0.448	30%	0.304	S	S	.	.	H	α-helix	trans	-64.7	-42.8	175.5	-72	-175	-69.7	0	0	111.8	F88 K89 C94 L95 L96	F88-M92 HydrophobicContact CB-CE 4.25Å; F88-M92 WeakPolarHBondContact O-CE 3.4Å; F88-M92 WeakPolarHBondContact O-CG 3.23Å; F88-M92 PolarHBondContact O-N 3.19Å; K89-M92 PolarHBondContact O-N 3.37Å; M92-C94 VanDerWaalsContact C-N 3.27Å; M92-C94 PolarHBondContact O-N 3.25Å; M92-L95 PolarHBondContact O-N 3.28Å; M92-L96 WeakPolarHBondContact O-CA 3.39Å; M92-L96 PolarHBondContact O-N 2.84Å
93	D	91	Very high	93.1	Very high	99 Å²	99	56.5 Å²	56.5	53%	0.529	27%	0.272	S	S	.	.	H	α-helix	trans	-63.2	-33.5	176.9	-68.3	-12.3	0	0	0	111.5	K89 L96	K89-D93 WeakPolarHBondContact CG-OD2 3.48Å; K89-D93 WeakPolarHBondContact O-CB 3.21Å; K89-D93 PolarHBondContact O-N 3.11Å; D93-L96 WeakPolarHBondContact O-CD2 3.49Å
94	C	90.5	Very high	93.2	Very high	22 Å²	22	54.9 Å²	54.9	15%	0.149	26%	0.263	C	S	.	.	H	α-helix	trans	-74.7	-40	178.4	-175.7	0	0	0	0	113.3	S90 T91 M92 V184	S90-C94 VanDerWaalsContact O-CB 3.29Å; S90-C94 WeakPolarHBondContact O-CB 3.35Å; S90-C94 PolarHBondContact O-N 3.1Å; S90-C94 VanDerWaalsContact O-N 3.09Å; T91-C94 PolarHBondContact O-N 3.48Å; M92-C94 VanDerWaalsContact C-N 3.27Å; M92-C94 PolarHBondContact O-N 3.25Å; C94-V184 HydrophobicContact CB-CB 4.1Å; C94-V184 HydrophobicContact CB-CG1 3.97Å
95	L	90	Very high	93.3	Very high	16 Å²	16	45.7 Å²	45.7	8%	0.084	23%	0.231	C	C	.	.	H	α-helix	trans	-96.5	-12.8	-174.3	-73.7	170.3	0	0	0	113.5	Y68 I70 T91 M92 A97 C99 I156 I186 M189	Y68-L95 HydrophobicContact CD2-CB 3.9Å; Y68-L95 HydrophobicContact CD2-CD1 3.79Å; Y68-L95 HydrophobicContact CD2-CD2 4.2Å; Y68-L95 HydrophobicContact CD2-CG 4.19Å; Y68-L95 HydrophobicContact CE2-CB 4.06Å; Y68-L95 HydrophobicContact CE2-CD2 4.2Å; Y68-L95 HydrophobicContact CG-CD1 4.06Å; I70-L95 HydrophobicContact CD1-CD1 3.73Å; T91-L95 HydrophobicContact CG2-CD1 4.28Å; T91-L95 PolarHBondContact O-N 2.89Å; T91-L95 VanDerWaalsContact O-N 3.1Å; M92-L95 PolarHBondContact O-N 3.28Å; L95-A97 PolarHBondContact O-N 2.87Å; L95-A97 VanDerWaalsContact O-N 3.16Å; L95-C99 VanDerWaalsContact CD1-SG 3.53Å; L95-I156 HydrophobicContact CD1-CD1 3.93Å; L95-I156 HydrophobicContact CD2-CD1 4.23Å; L95-I186 HydrophobicContact CD2-CD1 3.6Å; L95-M189 HydrophobicContact CD2-CE 4.08Å; L95-M189 HydrophobicContact CD2-SD 3.61Å
96	L	90.8	Very high	93.4	Very high	134 Å²	134	44.1 Å²	44.1	70%	0.702	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.7	31.7	-176.5	-56.4	175.5	0	0	0	113	M92 D93	M92-L96 WeakPolarHBondContact O-CA 3.39Å; M92-L96 PolarHBondContact O-N 2.84Å; D93-L96 WeakPolarHBondContact O-CD2 3.49Å
97	A	91.1	Very high	93.4	Very high	23 Å²	23	40.1 Å²	40.1	19%	0.19	20%	0.202	C	C	.	.	S	Bend	trans	-152.7	166.4	-175	0	0	0	0	0	111.8	P66 Y68 L95 C99	P66-A97 HydrophobicContact CB-CB 3.99Å; P66-A97 HydrophobicContact CG-CB 3.74Å; Y68-A97 HydrophobicContact CD2-CB 3.84Å; Y68-A97 HydrophobicContact CE2-CB 3.56Å; L95-A97 PolarHBondContact O-N 2.87Å; L95-A97 VanDerWaalsContact O-N 3.16Å; A97-C99 PolarHBondContact O-N 3.07Å; A97-C99 PolarHBondContact O-SG 3.08Å
98	K	92.9	Very high	93.4	Very high	138 Å²	138	40.2 Å²	40.2	60%	0.6	20%	0.202	S	C	*	.			trans	-64	131.8	175.1	-172.4	175.8	-178.3	176.6	0	110.6	P67 Y68	P67-K98 CarbonylContact C-O 3.59Å; P67-K98 VanDerWaalsContact CA-O 3.29Å; P67-K98 WeakPolarHBondContact CA-O 3.36Å; P67-K98 HydrophobicContact CB-CB 4.39Å; P67-K98 HydrophobicContact CB-CG 4.38Å; Y68-K98 PolarHBondContact N-O 3.34Å
99	C	93.6	Very high	93.4	Very high	21 Å²	21	39.9 Å²	39.9	14%	0.142	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	137.5	-178.3	-59.9	0	0	0	0	110.9	Y68 I70 T91 L95 A97	Y68-C99 CarbonylContact O-C 3.56Å; Y68-C99 WeakPolarHBondContact O-CA 3.35Å; I70-C99 HydrophobicContact CD1-CB 3.88Å; T91-C99 HydrophobicContact CG2-CB 3.99Å; L95-C99 VanDerWaalsContact CD1-SG 3.53Å; A97-C99 PolarHBondContact O-N 3.07Å; A97-C99 PolarHBondContact O-SG 3.08Å
100	F	95.5	Very high	93.3	Very high	63 Å²	63	36.7 Å²	36.7	28%	0.276	19%	0.192	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	129	168.3	-72	-67.5	0	0	0	109.5	P67 Y68 I70 Y102	P67-F100 HydrophobicContact CB-CD2 3.82Å; P67-F100 HydrophobicContact CB-CE2 3.79Å; P67-F100 HydrophobicContact CG-CD2 4.2Å; P67-F100 HydrophobicContact CG-CE2 3.98Å; Y68-F100 PolarHBondContact O-N 3.14Å; I70-F100 PolarHBondContact N-O 3.4Å; F100-Y102 HydrophobicContact CB-CE2 3.73Å
101	L	96.9	Very high	93.3	Very high	3 Å²	3	36.2 Å²	36.2	2%	0.016	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	139	-179.4	-57.9	-175.7	0	0	0	110	I70 L72 I87 F88 T91 I130 Q131	I70-L101 HydrophobicContact CB-CD2 3.81Å; I70-L101 HydrophobicContact CD1-CD2 3.99Å; I70-L101 HydrophobicContact CG1-CD2 4.45Å; I70-L101 HydrophobicContact CG2-CD2 4.06Å; L72-L101 HydrophobicContact CD1-CB 4.15Å; L72-L101 HydrophobicContact CD1-CD1 4.27Å; L72-L101 HydrophobicContact CD2-CD2 4.37Å; L72-L101 HydrophobicContact CG-CB 4.46Å; I87-L101 HydrophobicContact CG2-CD1 3.64Å; F88-L101 HydrophobicContact CD1-CD1 3.61Å; F88-L101 HydrophobicContact CD1-CG 4.38Å; F88-L101 HydrophobicContact CE1-CD1 3.61Å; F88-L101 HydrophobicContact CE1-CG 4.34Å; F88-L101 HydrophobicContact CG-CD1 4.23Å; F88-L101 HydrophobicContact CZ-CD1 4.23Å; T91-L101 HydrophobicContact CG2-CD2 4.21Å; L101-I130 HydrophobicContact CB-CG1 3.89Å; L101-I130 HydrophobicContact CD1-CG1 4.22Å; L101-Q131 PolarHBondContact O-N 3.47Å
102	Y	96.7	Very high	93.2	Very high	20 Å²	20	40.7 Å²	40.7	8%	0.078	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	140	-178.1	-64.3	-85.2	0	0	0	111.3	H69 I70 L72 F100 Q131 L133 Y155	H69-Y102 HydrophobicContact CB-CD2 4.18Å; H69-Y102 HydrophobicContact CB-CE2 3.61Å; H69-Y102 PolarHBondContact CE1-OH 3.46Å; H69-Y102 AromaticContact CG-CE2 3.81Å; H69-Y102 AromaticContact ND1-CE2 3.25Å; H69-Y102 VanDerWaalsContact ND1-CE2 3.25Å; H69-Y102 WeakPolarHBondContact ND1-CE2 3.27Å; H69-Y102 AromaticContact ND1-CZ 3.44Å; H69-Y102 PolarHBondContact ND1-OH 3.31Å; I70-Y102 PolarHBondContact O-N 2.91Å; L72-Y102 PolarHBondContact N-O 2.99Å; F100-Y102 HydrophobicContact CB-CE2 3.73Å; Y102-Q131 CarbonylContact C-O 3.54Å; Y102-Q131 VanDerWaalsContact CA-O 3.22Å; Y102-Q131 WeakPolarHBondContact CA-O 3.44Å; Y102-Q131 HydrophobicContact CD1-CB 3.64Å; Y102-Q131 HydrophobicContact CE1-CB 3.67Å; Y102-Q131 HydrophobicContact CE1-CG 4.35Å; Y102-Q131 PolarHBondContact OH-OE1 2.73Å; Y102-L133 HydrophobicContact CD1-CD1 3.88Å; Y102-L133 HydrophobicContact CD1-CD2 3.73Å; Y102-L133 HydrophobicContact CD1-CG 3.71Å; Y102-L133 HydrophobicContact CE1-CD2 4.2Å; Y102-L133 HydrophobicContact CG-CD1 3.96Å; Y102-L133 HydrophobicContact CG-CG 4.22Å; Y102-Y155 HydrophobicContact CD2-CE1 4.29Å
103	V	95.9	Very high	93.1	Very high	4 Å²	4	43.3 Å²	43.3	2%	0.024	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	129.6	171.8	173	0	0	0	0	109	L72 V107 M108 L125 I130 Q131 R132 L133	L72-V103 HydrophobicContact CB-CG2 4.02Å; L72-V103 HydrophobicContact CD1-CG2 3.99Å; L72-V103 HydrophobicContact CG-CG2 4.49Å; V103-V107 HydrophobicContact CG1-CB 4.23Å; V103-V107 HydrophobicContact CG1-CG1 4.01Å; V103-M108 HydrophobicContact CG1-CB 4.26Å; V103-L125 HydrophobicContact CG2-CB 4.47Å; V103-L125 HydrophobicContact CG2-CD2 3.41Å; V103-L125 VanDerWaalsContact CG2-CD2 3.41Å; V103-L125 HydrophobicContact CG2-CG 4.38Å; V103-I130 HydrophobicContact CB-CG2 4.01Å; V103-I130 HydrophobicContact CG2-CG2 3.39Å; V103-Q131 PolarHBondContact N-O 3.35Å; V103-R132 CarbonylContact O-C 3.52Å; V103-R132 WeakPolarHBondContact O-CA 3.46Å; V103-L133 PolarHBondContact O-N 3.1Å
104	T	96.1	Very high	92.9	Very high	1 Å²	1	42.7 Å²	42.7	1%	0.006	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	148	174.8	47	0	0	0	0	111.6	L71 C106 V107 M108 L133 L146	L71-T104 HydrophobicContact CD2-CG2 4.39Å; T104-C106 VanDerWaalsContact CB-SG 3.57Å; T104-C106 PolarHBondContact O-N 3.31Å; T104-C106 VanDerWaalsContact O-N 3.1Å; T104-C106 PolarHBondContact OG1-SG 2.97Å; T104-V107 PolarHBondContact O-N 3.43Å; T104-V107 VanDerWaalsContact O-N 3.09Å; T104-V107 WeakPolarHBondContact OG1-CG2 3.36Å; T104-M108 PolarHBondContact O-N 2.8Å; T104-L133 WeakPolarHBondContact CA-O 3.4Å; T104-L133 HydrophobicContact CG2-CB 4.31Å; T104-L146 HydrophobicContact CG2-CD2 4.41Å
105	D	94.7	Very high	92.4	Very high	42 Å²	42	45 Å²	45	23%	0.225	23%	0.229	C	C	.	.	H	α-helix	trans	-50.1	-36.6	175.3	-71.5	-29.2	0	0	0	114.2	M108 G109 R132 L133 T134 C135	D105-M108 PolarHBondContact O-N 3.36Å; D105-G109 PolarHBondContact O-N 2.91Å; D105-R132 IonicContact OD1-CZ 2.83Å; D105-R132 IonicContact OD1-NE 3.92Å; D105-R132 PolarHBondContact OD1-NE 3.05Å; D105-R132 IonicContact OD1-NH2 2.64Å; D105-R132 PolarHBondContact OD1-NH2 2.74Å; D105-L133 PolarHBondContact N-O 2.87Å; D105-T134 WeakPolarHBondContact OD2-CA 3.4Å; D105-C135 HydrophobicContact CB-CB 4.1Å; D105-C135 PolarHBondContact N-SG 2.99Å; D105-C135 PolarHBondContact OD2-N 3.14Å
106	C	94.5	Very high	92.2	Very high	3 Å²	3	50.4 Å²	50.4	2%	0.02	25%	0.254	C	S	.	.	H	α-helix	trans	-67.1	-43.7	179.7	53.7	0	0	0	0	112.7	T104 M108 G109 E110 C145	T104-C106 VanDerWaalsContact CB-SG 3.57Å; T104-C106 PolarHBondContact O-N 3.31Å; T104-C106 VanDerWaalsContact O-N 3.1Å; T104-C106 PolarHBondContact OG1-SG 2.97Å; C106-M108 VanDerWaalsContact C-N 3.31Å; C106-G109 CarbonylContact O-C 3.58Å; C106-G109 PolarHBondContact O-N 3.4Å; C106-E110 WeakPolarHBondContact O-CB 3.44Å; C106-E110 PolarHBondContact O-N 2.9Å; C106-C145 WeakPolarHBondContact SG-CB 3.47Å; C106-C145 PolarHBondContact SG-SG 2.89Å
107	V	94.4	Very high	92	Very high	0 Å²	0	54.8 Å²	54.8	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-61.2	-42.5	173.5	168.7	0	0	0	0	110.1	T74 V103 T104 E110 I111 A142 L146	T74-V107 HydrophobicContact CG2-CB 4.21Å; T74-V107 HydrophobicContact CG2-CG1 3.63Å; T74-V107 HydrophobicContact CG2-CG2 4.48Å; V103-V107 HydrophobicContact CG1-CB 4.23Å; V103-V107 HydrophobicContact CG1-CG1 4.01Å; T104-V107 PolarHBondContact O-N 3.43Å; T104-V107 VanDerWaalsContact O-N 3.09Å; T104-V107 WeakPolarHBondContact OG1-CG2 3.36Å; V107-E110 PolarHBondContact O-N 3.39Å; V107-I111 HydrophobicContact CG1-CD1 4.22Å; V107-I111 WeakPolarHBondContact O-CG1 3.44Å; V107-I111 PolarHBondContact O-N 3.4Å; V107-A142 HydrophobicContact CG2-CB 3.68Å; V107-L146 HydrophobicContact CG2-CD1 4.49Å
108	M	93.9	Very high	91.9	Very high	6 Å²	6	56.7 Å²	56.7	3%	0.03	26%	0.264	C	S	.	.	H	α-helix	trans	-62.6	-46.7	175.5	-167.9	64.4	-168.2	0	0	111.5	V103 T104 D105 C106 E110 I111 E112 L122 L125 R126	V103-M108 HydrophobicContact CG1-CB 4.26Å; T104-M108 PolarHBondContact O-N 2.8Å; D105-M108 PolarHBondContact O-N 3.36Å; C106-M108 VanDerWaalsContact C-N 3.31Å; M108-E110 VanDerWaalsContact C-N 3.31Å; M108-E110 PolarHBondContact O-N 3.41Å; M108-I111 PolarHBondContact O-N 3.37Å; M108-E112 HydrophobicContact CE-CG 4.31Å; M108-E112 WeakPolarHBondContact CE-OE1 3.32Å; M108-E112 WeakPolarHBondContact O-CG 3.3Å; M108-E112 PolarHBondContact O-N 3.22Å; M108-L122 HydrophobicContact CE-CG 4.1Å; M108-L125 HydrophobicContact SD-CB 4.44Å; M108-R126 HydrophobicContact CE-CG 3.66Å
109	G	92.3	Very high	91.8	Very high	14 Å²	14	57.3 Å²	57.3	14%	0.144	26%	0.262	C	S	.	.	H	α-helix	trans	-68.4	-26.4	178	0	0	0	0	0	113.8	D105 C106 K113	D105-G109 PolarHBondContact O-N 2.91Å; C106-G109 CarbonylContact O-C 3.58Å; C106-G109 PolarHBondContact O-N 3.4Å; G109-K113 WeakPolarHBondContact O-CD 3.49Å; G109-K113 VanDerWaalsContact O-CG 3.26Å; G109-K113 WeakPolarHBondContact O-CG 3.5Å; G109-K113 PolarHBondContact O-N 3.39Å
110	E	91.6	Very high	91.7	Very high	56 Å²	56	60.4 Å²	60.4	26%	0.262	28%	0.28	S	S	.	.	H	α-helix	trans	-69.9	-48	171.6	-173.8	-179.8	156.4	0	0	110.4	T74 C106 V107 M108 E112 K113 M114 A142	T74-E110 HydrophobicContact CG2-CB 3.98Å; T74-E110 HydrophobicContact CG2-CG 4.04Å; T74-E110 PolarHBondContact OG1-OE1 3.18Å; C106-E110 WeakPolarHBondContact O-CB 3.44Å; C106-E110 PolarHBondContact O-N 2.9Å; V107-E110 PolarHBondContact O-N 3.39Å; M108-E110 VanDerWaalsContact C-N 3.31Å; M108-E110 PolarHBondContact O-N 3.41Å; E110-E112 VanDerWaalsContact C-N 3.33Å; E110-E112 PolarHBondContact O-N 3.22Å; E110-K113 WeakPolarHBondContact O-CB 3.29Å; E110-K113 PolarHBondContact O-N 3.4Å; E110-K113 VanDerWaalsContact O-N 3.1Å; E110-M114 WeakPolarHBondContact O-CG 3.26Å; E110-M114 PolarHBondContact O-N 3.28Å; E110-A142 VanDerWaalsContact OE2-CB 3.23Å; E110-A142 WeakPolarHBondContact OE2-CB 3.46Å
111	I	92.2	Very high	91.6	Very high	4 Å²	4	57.4 Å²	57.4	2%	0.021	27%	0.267	C	S	.	.	H	α-helix	trans	-64.8	-36.8	179.7	-71	168.8	0	0	0	112.3	T74 V107 M108 K113 M114 L122 L125	T74-I111 HydrophobicContact CG2-CD1 3.83Å; T74-I111 HydrophobicContact CG2-CG1 3.58Å; V107-I111 HydrophobicContact CG1-CD1 4.22Å; V107-I111 WeakPolarHBondContact O-CG1 3.44Å; V107-I111 PolarHBondContact O-N 3.4Å; M108-I111 PolarHBondContact O-N 3.37Å; I111-K113 PolarHBondContact O-N 3.09Å; I111-M114 PolarHBondContact O-N 3.33Å; I111-M114 VanDerWaalsContact O-N 3.14Å; I111-L122 HydrophobicContact CG2-CB 3.96Å; I111-L125 HydrophobicContact CD1-CD1 3.03Å; I111-L125 HydrophobicContact CG1-CD1 4.45Å
112	E	91.3	Very high	91.5	Very high	95 Å²	95	58.8 Å²	58.8	44%	0.444	28%	0.275	S	S	.	.	H	α-helix	trans	-64.7	-26.5	175.4	-75.7	179.8	167.3	0	0	113.1	M108 E110 L122 R126	M108-E112 HydrophobicContact CE-CG 4.31Å; M108-E112 WeakPolarHBondContact CE-OE1 3.32Å; M108-E112 WeakPolarHBondContact O-CG 3.3Å; M108-E112 PolarHBondContact O-N 3.22Å; E110-E112 VanDerWaalsContact C-N 3.33Å; E110-E112 PolarHBondContact O-N 3.22Å; E112-L122 HydrophobicContact CG-CD1 3.72Å; E112-R126 IonicContact OE1-CZ 2.84Å; E112-R126 IonicContact OE1-NH2 3.81Å; E112-R126 PolarHBondContact OE1-NH2 3.3Å
113	K	89.5	Confident	91.3	Very high	145 Å²	145	65.5 Å²	65.5	63%	0.63	30%	0.304	S	S	*	.	H	α-helix	trans	-81	-18.5	174.6	-70.3	169.8	-175.8	-176.8	0	113.1	G109 E110 I111 T140	G109-K113 WeakPolarHBondContact O-CD 3.49Å; G109-K113 VanDerWaalsContact O-CG 3.26Å; G109-K113 WeakPolarHBondContact O-CG 3.5Å; G109-K113 PolarHBondContact O-N 3.39Å; E110-K113 WeakPolarHBondContact O-CB 3.29Å; E110-K113 PolarHBondContact O-N 3.4Å; E110-K113 VanDerWaalsContact O-N 3.1Å; I111-K113 PolarHBondContact O-N 3.09Å; K113-T140 PolarHBondContact NZ-OG1 3.39Å
114	M	86	Confident	91.2	Very high	87 Å²	87	67.7 Å²	67.7	43%	0.429	32%	0.315	S	S	.	.	S	Bend	trans	-75.7	154.8	-178.2	-63.3	-61.5	-77.6	0	0	111.5	E110 I111 Y118	E110-M114 WeakPolarHBondContact O-CG 3.26Å; E110-M114 PolarHBondContact O-N 3.28Å; I111-M114 PolarHBondContact O-N 3.33Å; I111-M114 VanDerWaalsContact O-N 3.14Å; M114-Y118 HydrophobicContact CB-CD2 3.36Å; M114-Y118 HydrophobicContact CB-CE2 3.86Å; M114-Y118 HydrophobicContact CB-CG 3.85Å; M114-Y118 HydrophobicContact CE-CD2 4.33Å; M114-Y118 HydrophobicContact CE-CE2 3.57Å; M114-Y118 HydrophobicContact CG-CD2 4.24Å; M114-Y118 HydrophobicContact CG-CE2 4.38Å
115	S	81	Confident	91.1	Very high	69 Å²	69	68 Å²	68	48%	0.483	32%	0.317	S	S	.	.			trans	-57	169.6	-178.3	70.1	0	0	0	0	114.1	R117 Y118	S115-R117 PolarHBondContact O-N 2.92Å; S115-Y118 WeakPolarHBondContact O-CD2 3.1Å; S115-Y118 PolarHBondContact O-N 3.15Å
116	E	86.4	Confident	91	Very high	130 Å²	130	73.3 Å²	73.3	61%	0.607	33%	0.334	S	S	*	.	G	3₁₀ helix	trans	-51	-22.2	-179.5	-165.9	158.1	-160.7	0	0	115.2	Y118 R119	E116-Y118 PolarHBondContact O-N 3.22Å; E116-Y118 VanDerWaalsContact O-N 3.14Å; E116-R119 HydrophobicContact CG-CG 4.45Å; E116-R119 WeakPolarHBondContact O-CG 3.46Å; E116-R119 PolarHBondContact O-N 3.44Å; E116-R119 IonicContact OE1-CZ 2.84Å; E116-R119 IonicContact OE1-NE 2.7Å; E116-R119 IonicContact OE1-NH1 3.33Å; E116-R119 PolarHBondContact OE1-NH1 2.92Å; E116-R119 IonicContact OE1-NH2 3.22Å; E116-R119 PolarHBondContact OE1-NH2 3.48Å
117	R	85.2	Confident	91	Very high	226 Å²	226	75.3 Å²	75.3	85%	0.853	34%	0.344	S	S	*	.	G	3₁₀ helix	trans	-57.3	-25	174.3	-62.4	-176.4	-179.5	-176.7	0.4	113.6	S115	S115-R117 PolarHBondContact O-N 2.92Å
118	Y	89.3	Confident	91	Very high	64 Å²	64	84.4 Å²	84.4	25%	0.251	39%	0.387	S	S	.	.	G	3₁₀ helix	trans	-97.2	7.1	-175.5	-63.4	-81.9	0	0	0	114	N78 M114 S115 E116 V120 A121 L122	N78-Y118 HydrophobicContact CB-CE1 4.21Å; N78-Y118 WeakPolarHBondContact ND2-CE1 3.35Å; N78-Y118 WeakPolarHBondContact OD1-CD1 3.49Å; N78-Y118 WeakPolarHBondContact OD1-CE1 3.38Å; M114-Y118 HydrophobicContact CB-CD2 3.36Å; M114-Y118 HydrophobicContact CB-CE2 3.86Å; M114-Y118 HydrophobicContact CB-CG 3.85Å; M114-Y118 HydrophobicContact CE-CD2 4.33Å; M114-Y118 HydrophobicContact CE-CE2 3.57Å; M114-Y118 HydrophobicContact CG-CD2 4.24Å; M114-Y118 HydrophobicContact CG-CE2 4.38Å; S115-Y118 WeakPolarHBondContact O-CD2 3.1Å; S115-Y118 PolarHBondContact O-N 3.15Å; E116-Y118 PolarHBondContact O-N 3.22Å; E116-Y118 VanDerWaalsContact O-N 3.14Å; Y118-V120 PolarHBondContact O-N 3.5Å; Y118-A121 WeakPolarHBondContact O-CB 3.2Å; Y118-A121 PolarHBondContact O-N 3.47Å; Y118-A121 VanDerWaalsContact O-N 3.08Å; Y118-L122 PolarHBondContact O-N 3.11Å
119	R	90.9	Very high	91	Very high	151 Å²	151	90.6 Å²	90.6	57%	0.57	41%	0.41	S	S	*	.	H	α-helix	trans	-57.6	-35.4	178.2	-78.7	-172.9	175	159.8	13.8	113.5	E116 K123	E116-R119 HydrophobicContact CG-CG 4.45Å; E116-R119 WeakPolarHBondContact O-CG 3.46Å; E116-R119 PolarHBondContact O-N 3.44Å; E116-R119 IonicContact OE1-CZ 2.84Å; E116-R119 IonicContact OE1-NE 2.7Å; E116-R119 IonicContact OE1-NH1 3.33Å; E116-R119 PolarHBondContact OE1-NH1 2.92Å; E116-R119 IonicContact OE1-NH2 3.22Å; E116-R119 PolarHBondContact OE1-NH2 3.48Å; R119-K123 WeakPolarHBondContact O-CG 3.41Å; R119-K123 PolarHBondContact O-N 2.84Å
120	V	92.6	Very high	91.2	Very high	85 Å²	85	90.5 Å²	90.5	52%	0.515	41%	0.406	S	S	.	.	H	α-helix	trans	-67.9	-43.1	176.9	-178	0	0	0	0	110.6	I81 Y118 L122 K123 I124	I81-V120 HydrophobicContact CD1-CB 4.38Å; I81-V120 HydrophobicContact CD1-CG1 4.19Å; Y118-V120 PolarHBondContact O-N 3.5Å; V120-L122 VanDerWaalsContact C-N 3.33Å; V120-L122 PolarHBondContact O-N 2.86Å; V120-K123 PolarHBondContact O-N 2.83Å; V120-I124 HydrophobicContact CG1-CD1 4.08Å; V120-I124 WeakPolarHBondContact O-CG1 3.31Å; V120-I124 PolarHBondContact O-N 3.1Å
121	A	93.5	Very high	91.4	Very high	1 Å²	1	92.1 Å²	92.1	1%	0.008	41%	0.413	C	S	.	.	H	α-helix	trans	-60.6	-43.5	175.5	0	0	0	0	0	111.7	V77 I81 Y118 K123 I124 L125	V77-A121 HydrophobicContact CG1-CB 3.72Å; I81-A121 HydrophobicContact CD1-CB 3.62Å; Y118-A121 WeakPolarHBondContact O-CB 3.2Å; Y118-A121 PolarHBondContact O-N 3.47Å; Y118-A121 VanDerWaalsContact O-N 3.08Å; A121-K123 VanDerWaalsContact C-N 3.35Å; A121-K123 PolarHBondContact O-N 3.04Å; A121-I124 PolarHBondContact O-N 2.77Å; A121-L125 WeakPolarHBondContact O-CG 3.22Å; A121-L125 PolarHBondContact O-N 2.97Å
122	L	93.4	Very high	91.5	Very high	32 Å²	32	99.5 Å²	99.5	17%	0.168	44%	0.441	C	S	.	.	H	α-helix	trans	-62.2	-39.8	176.7	-178.4	152.4	0	0	0	112.3	M108 I111 E112 Y118 V120 L125 R126	M108-L122 HydrophobicContact CE-CG 4.1Å; I111-L122 HydrophobicContact CG2-CB 3.96Å; E112-L122 HydrophobicContact CG-CD1 3.72Å; Y118-L122 PolarHBondContact O-N 3.11Å; V120-L122 VanDerWaalsContact C-N 3.33Å; V120-L122 PolarHBondContact O-N 2.86Å; L122-L125 PolarHBondContact O-N 2.83Å; L122-R126 VanDerWaalsContact CD2-CZ 3.46Å; L122-R126 WeakPolarHBondContact O-CG 3.39Å; L122-R126 PolarHBondContact O-N 2.78Å
123	K	92.8	Very high	91.7	Very high	161 Å²	161	96.3 Å²	96.3	70%	0.7	43%	0.427	S	S	*	.	H	α-helix	trans	-63.8	-43.2	174.1	-74.8	-178.1	-179.6	-173.9	0	112	R119 V120 A121 L125 R126	R119-K123 WeakPolarHBondContact O-CG 3.41Å; R119-K123 PolarHBondContact O-N 2.84Å; V120-K123 PolarHBondContact O-N 2.83Å; A121-K123 VanDerWaalsContact C-N 3.35Å; A121-K123 PolarHBondContact O-N 3.04Å; K123-L125 VanDerWaalsContact C-N 3.34Å; K123-L125 PolarHBondContact O-N 3.38Å; K123-R126 PolarHBondContact O-N 3.2Å
124	I	93.5	Very high	92	Very high	50 Å²	50	94.5 Å²	94.5	26%	0.256	43%	0.428	S	S	.	.	H	α-helix	trans	-62.9	-42.4	178.6	-67.4	166	0	0	0	110.6	I81 I87 V120 A121 R126 D127 I130	I81-I124 HydrophobicContact CD1-CD1 3.92Å; I81-I124 HydrophobicContact CG1-CD1 3.77Å; I87-I124 HydrophobicContact CD1-CG2 3.75Å; V120-I124 HydrophobicContact CG1-CD1 4.08Å; V120-I124 WeakPolarHBondContact O-CG1 3.31Å; V120-I124 PolarHBondContact O-N 3.1Å; A121-I124 PolarHBondContact O-N 2.77Å; I124-R126 VanDerWaalsContact C-N 3.29Å; I124-R126 PolarHBondContact O-N 3.05Å; I124-D127 WeakPolarHBondContact O-CB 3.27Å; I124-D127 PolarHBondContact O-N 2.86Å; I124-I130 WeakPolarHBondContact O-CD1 3.23Å
125	L	93.8	Very high	92.3	Very high	8 Å²	8	91.7 Å²	91.7	4%	0.042	42%	0.417	C	S	.	.	H	α-helix	trans	-74.7	-16.2	-178.2	-67.2	171.8	0	0	0	114.8	L72 V77 V103 M108 I111 A121 L122 K123 D127 I130	L72-L125 HydrophobicContact CD1-CD2 3.83Å; V77-L125 HydrophobicContact CG1-CD1 4.39Å; V77-L125 HydrophobicContact CG1-CD2 4.4Å; V77-L125 HydrophobicContact CG1-CG 4.22Å; V77-L125 HydrophobicContact CG2-CD1 4.14Å; V77-L125 HydrophobicContact CG2-CD2 3.52Å; V77-L125 HydrophobicContact CG2-CG 4.1Å; V103-L125 HydrophobicContact CG2-CB 4.47Å; V103-L125 HydrophobicContact CG2-CD2 3.41Å; V103-L125 VanDerWaalsContact CG2-CD2 3.41Å; V103-L125 HydrophobicContact CG2-CG 4.38Å; M108-L125 HydrophobicContact SD-CB 4.44Å; I111-L125 HydrophobicContact CD1-CD1 3.03Å; I111-L125 HydrophobicContact CG1-CD1 4.45Å; A121-L125 WeakPolarHBondContact O-CG 3.22Å; A121-L125 PolarHBondContact O-N 2.97Å; L122-L125 PolarHBondContact O-N 2.83Å; K123-L125 VanDerWaalsContact C-N 3.34Å; K123-L125 PolarHBondContact O-N 3.38Å; L125-D127 VanDerWaalsContact C-N 3.31Å; L125-I130 HydrophobicContact CD2-CD1 4.3Å
126	R	93.4	Very high	92.7	Very high	153 Å²	153	97.9 Å²	97.9	58%	0.577	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.7	1.4	173.1	-71.5	-178.3	-179.2	-179	0	113.2	M108 E112 L122 K123 I124	M108-R126 HydrophobicContact CE-CG 3.66Å; E112-R126 IonicContact OE1-CZ 2.84Å; E112-R126 IonicContact OE1-NH2 3.81Å; E112-R126 PolarHBondContact OE1-NH2 3.3Å; L122-R126 VanDerWaalsContact CD2-CZ 3.46Å; L122-R126 WeakPolarHBondContact O-CG 3.39Å; L122-R126 PolarHBondContact O-N 2.78Å; K123-R126 PolarHBondContact O-N 3.2Å; I124-R126 VanDerWaalsContact C-N 3.29Å; I124-R126 PolarHBondContact O-N 3.05Å
127	D	94.4	Very high	92.9	Very high	45 Å²	45	95.3 Å²	95.3	24%	0.241	43%	0.426	C	S	.	.	S	Bend	trans	-59.8	134.7	173.6	-170.4	-35.2	0	0	0	110.1	F88 I124 L125 R129 I130	F88-D127 HydrophobicContact CZ-CB 4.43Å; I124-D127 WeakPolarHBondContact O-CB 3.27Å; I124-D127 PolarHBondContact O-N 2.86Å; L125-D127 VanDerWaalsContact C-N 3.31Å; D127-R129 PolarHBondContact O-N 3.2Å; D127-R129 VanDerWaalsContact O-N 3.1Å; D127-R129 WeakPolarHBondContact OD1-CG 3.15Å; D127-R129 PolarHBondContact OD1-N 3.1Å; D127-R129 VanDerWaalsContact OD1-N 3.08Å; D127-R129 IonicContact OD1-NE 3.19Å; D127-R129 PolarHBondContact OD1-NE 3.09Å; D127-R129 IonicContact OD2-CZ 3.95Å; D127-R129 IonicContact OD2-NE 3.13Å; D127-R129 PolarHBondContact OD2-NE 2.71Å; D127-R129 VanDerWaalsContact OD2-NE 3.13Å; D127-R129 IonicContact OD2-NH2 2.73Å; D127-R129 PolarHBondContact OD2-NH2 3.37Å; D127-I130 HydrophobicContact CB-CD1 4.49Å; D127-I130 PolarHBondContact O-N 3.03Å
128	E	94.6	Very high	93.1	Very high	191 Å²	191	96.7 Å²	96.7	89%	0.893	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.4	-23.8	-177.6	-62.7	178.8	175.9	0	0	113.1	I130	E128-I130 PolarHBondContact O-N 3.39Å
129	R	94.2	Very high	93.1	Very high	135 Å²	135	96.3 Å²	96.3	51%	0.509	45%	0.447	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.7	-17.5	176.9	-60.9	178	-68.8	167.8	-0.6	113	F88 D127	F88-R129 HydrophobicContact CD1-CB 4.33Å; F88-R129 HydrophobicContact CE1-CB 3.38Å; F88-R129 HydrophobicContact CE1-CG 4.45Å; F88-R129 VanDerWaalsContact CE2-CZ 3.45Å; F88-R129 HydrophobicContact CZ-CB 3.6Å; D127-R129 PolarHBondContact O-N 3.2Å; D127-R129 VanDerWaalsContact O-N 3.1Å; D127-R129 WeakPolarHBondContact OD1-CG 3.15Å; D127-R129 PolarHBondContact OD1-N 3.1Å; D127-R129 VanDerWaalsContact OD1-N 3.08Å; D127-R129 IonicContact OD1-NE 3.19Å; D127-R129 PolarHBondContact OD1-NE 3.09Å; D127-R129 IonicContact OD2-CZ 3.95Å; D127-R129 IonicContact OD2-NE 3.13Å; D127-R129 PolarHBondContact OD2-NE 2.71Å; D127-R129 VanDerWaalsContact OD2-NE 3.13Å; D127-R129 IonicContact OD2-NH2 2.73Å; D127-R129 PolarHBondContact OD2-NH2 3.37Å
130	I	95.8	Very high	92.9	Very high	13 Å²	13	91.6 Å²	91.6	7%	0.067	44%	0.435	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	119	176.6	-70.4	160.8	0	0	0	109.1	L72 F88 L101 V103 I124 L125 D127 E128	L72-I130 HydrophobicContact CD1-CD1 4.12Å; L72-I130 HydrophobicContact CD1-CG1 4.39Å; F88-I130 HydrophobicContact CE1-CD1 4.49Å; F88-I130 HydrophobicContact CE1-CG1 3.96Å; F88-I130 HydrophobicContact CE2-CD1 4.31Å; F88-I130 HydrophobicContact CZ-CD1 3.73Å; F88-I130 HydrophobicContact CZ-CG1 3.61Å; L101-I130 HydrophobicContact CB-CG1 3.89Å; L101-I130 HydrophobicContact CD1-CG1 4.22Å; V103-I130 HydrophobicContact CB-CG2 4.01Å; V103-I130 HydrophobicContact CG2-CG2 3.39Å; I124-I130 WeakPolarHBondContact O-CD1 3.23Å; L125-I130 HydrophobicContact CD2-CD1 4.3Å; D127-I130 HydrophobicContact CB-CD1 4.49Å; D127-I130 PolarHBondContact O-N 3.03Å; E128-I130 PolarHBondContact O-N 3.39Å
131	Q	96.1	Very high	92.8	Very high	89 Å²	89	93.7 Å²	93.7	42%	0.416	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	133	-179.1	-67.7	-178.3	7.8	0	0	111.2	L101 Y102 V103	L101-Q131 PolarHBondContact O-N 3.47Å; Y102-Q131 CarbonylContact C-O 3.54Å; Y102-Q131 VanDerWaalsContact CA-O 3.22Å; Y102-Q131 WeakPolarHBondContact CA-O 3.44Å; Y102-Q131 HydrophobicContact CD1-CB 3.64Å; Y102-Q131 HydrophobicContact CE1-CB 3.67Å; Y102-Q131 HydrophobicContact CE1-CG 4.35Å; Y102-Q131 PolarHBondContact OH-OE1 2.73Å; V103-Q131 PolarHBondContact N-O 3.35Å
132	R	95.2	Very high	92.8	Very high	159 Å²	159	93.7 Å²	93.7	60%	0.6	43%	0.434	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.4	126.9	178.9	-171.9	172.6	172.5	164.3	0.6	111	V103 D105	V103-R132 CarbonylContact O-C 3.52Å; V103-R132 WeakPolarHBondContact O-CA 3.46Å; D105-R132 IonicContact OD1-CZ 2.83Å; D105-R132 IonicContact OD1-NE 3.92Å; D105-R132 PolarHBondContact OD1-NE 3.05Å; D105-R132 IonicContact OD1-NH2 2.64Å; D105-R132 PolarHBondContact OD1-NH2 2.74Å
133	L	95.2	Very high	92.7	Very high	28 Å²	28	93.5 Å²	93.5	15%	0.147	43%	0.433	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	125.1	177.2	-66.3	179.6	0	0	0	111.3	L71 Y102 V103 T104 D105 Y155	L71-L133 HydrophobicContact CD2-CD1 3.6Å; Y102-L133 HydrophobicContact CD1-CD1 3.88Å; Y102-L133 HydrophobicContact CD1-CD2 3.73Å; Y102-L133 HydrophobicContact CD1-CG 3.71Å; Y102-L133 HydrophobicContact CE1-CD2 4.2Å; Y102-L133 HydrophobicContact CG-CD1 3.96Å; Y102-L133 HydrophobicContact CG-CG 4.22Å; V103-L133 PolarHBondContact O-N 3.1Å; T104-L133 WeakPolarHBondContact CA-O 3.4Å; T104-L133 HydrophobicContact CG2-CB 4.31Å; D105-L133 PolarHBondContact N-O 2.87Å; L133-Y155 HydrophobicContact CD1-CE1 4.43Å
134	T	94.3	Very high	92.8	Very high	107 Å²	107	89.7 Å²	89.7	66%	0.656	42%	0.421	S	S	*	.	P	Polyproline II helix	trans	-72	137.1	177.5	54.1	0	0	0	0	111.8	D105 R149	D105-T134 WeakPolarHBondContact OD2-CA 3.4Å; T134-R149 PolarHBondContact O-NH2 2.94Å
135	C	93.2	Very high	92.8	Very high	28 Å²	28	87.6 Å²	87.6	19%	0.189	41%	0.411	C	S	.	.	P	Polyproline II helix	trans	-98.9	139.3	-180	-66.7	0	0	0	0	111.6	D105 H137	D105-C135 HydrophobicContact CB-CB 4.1Å; D105-C135 PolarHBondContact N-SG 2.99Å; D105-C135 PolarHBondContact OD2-N 3.14Å; C135-H137 WeakPolarHBondContact CB-NE2 3.29Å
136	Q	90	Very high	92.8	Very high	200 Å²	200	87.2 Å²	87.2	94%	0.935	41%	0.409	S	S	*	.			trans	-101.4	13.1	-179	-65.1	-177.1	-14.1	0	0	113.6
137	H	90.3	Very high	92.9	Very high	76 Å²	76	80.9 Å²	80.9	35%	0.352	39%	0.387	S	S	.	.	S	Bend	trans	-114.7	159.5	-178.6	59.9	75.4	0	0	0	111.2	C135 G139 C145	C135-H137 WeakPolarHBondContact CB-NE2 3.29Å; H137-G139 PolarHBondContact CE1-O 3.31Å; H137-G139 PolarHBondContact ND1-O 3.23Å; H137-C145 WeakPolarHBondContact NE2-CB 3.47Å; H137-C145 PolarHBondContact NE2-SG 3.08Å
138	R	89.4	Confident	92.8	Very high	254 Å²	254	84.1 Å²	84.1	96%	0.958	40%	0.4	S	S	*	.	S	Bend	trans	-82.6	144.2	172.6	-63.9	-177.8	-179.4	-173.4	-0.1	109.9
139	G	88.3	Confident	92.7	Very high	57 Å²	57	77.7 Å²	77.7	59%	0.588	37%	0.368	S	S	*	.	S	Bend	trans	85.5	174.3	178.2	0	0	0	0	0	114.2	H137	H137-G139 PolarHBondContact CE1-O 3.31Å; H137-G139 PolarHBondContact ND1-O 3.23Å
140	T	87.6	Confident	92.5	Very high	52 Å²	52	71.2 Å²	71.2	32%	0.319	34%	0.344	S	S	.	.			trans	-116.6	33.9	-172.1	62.8	0	0	0	0	112.1	K113 A142	K113-T140 PolarHBondContact NZ-OG1 3.39Å; T140-A142 PolarHBondContact O-N 3Å
141	Y	89.9	Confident	92.1	Very high	129 Å²	129	75.1 Å²	75.1	51%	0.506	36%	0.36	S	S	.	.			trans	-85.5	100.5	178.1	-165.2	-120.5	0	0	0	109.4	D143 D144 C145	Y141-D143 HydrophobicContact CD1-CB 4.49Å; Y141-D143 HydrophobicContact CE1-CB 3.88Å; Y141-D143 PolarHBondContact OH-OD2 2.96Å; Y141-D144 HydrophobicContact CD1-CB 3.75Å; Y141-D144 VanDerWaalsContact CD1-OD2 3.23Å; Y141-D144 WeakPolarHBondContact CD1-OD2 3.47Å; Y141-D144 HydrophobicContact CE1-CB 4.25Å; Y141-D144 VanDerWaalsContact CE1-CG 3.47Å; Y141-D144 WeakPolarHBondContact CE1-OD2 3.08Å; Y141-C145 PolarHBondContact O-N 3.4Å
142	A	92.4	Very high	91.6	Very high	0 Å²	0	73.5 Å²	73.5	0%	0	36%	0.359	C	S	.	.	H	α-helix	trans	-65.9	-41	-171.3	0	0	0	0	0	112.8	V107 E110 T140 D144 C145 L146	V107-A142 HydrophobicContact CG2-CB 3.68Å; E110-A142 VanDerWaalsContact OE2-CB 3.23Å; E110-A142 WeakPolarHBondContact OE2-CB 3.46Å; T140-A142 PolarHBondContact O-N 3Å; A142-D144 PolarHBondContact O-N 3.08Å; A142-C145 WeakPolarHBondContact O-CB 3.41Å; A142-C145 PolarHBondContact O-N 3.33Å; A142-C145 VanDerWaalsContact O-N 3.12Å; A142-L146 WeakPolarHBondContact O-CG 3.37Å; A142-L146 PolarHBondContact O-N 3.01Å
143	D	93.3	Very high	91.2	Very high	28 Å²	28	67.9 Å²	67.9	15%	0.15	34%	0.338	C	S	.	.	H	α-helix	trans	-55.9	-48.2	-177.2	-60.3	-20.2	0	0	0	112.6	Y141 C145 L146 V147 L164	Y141-D143 HydrophobicContact CD1-CB 4.49Å; Y141-D143 HydrophobicContact CE1-CB 3.88Å; Y141-D143 PolarHBondContact OH-OD2 2.96Å; D143-C145 VanDerWaalsContact C-N 3.35Å; D143-L146 PolarHBondContact O-N 3.13Å; D143-V147 WeakPolarHBondContact O-CB 3.3Å; D143-V147 VanDerWaalsContact O-CG2 3.23Å; D143-V147 WeakPolarHBondContact O-CG2 3.41Å; D143-V147 PolarHBondContact O-N 3.42Å; D143-L164 HydrophobicContact CB-CD1 4.14Å
144	D	93	Very high	90.9	Very high	81 Å²	81	69.2 Å²	69.2	43%	0.433	35%	0.348	S	S	.	.	H	α-helix	trans	-68.2	-37.1	179.8	-73.7	-10.6	0	0	0	111.7	Y141 A142 E148 R167	Y141-D144 HydrophobicContact CD1-CB 3.75Å; Y141-D144 VanDerWaalsContact CD1-OD2 3.23Å; Y141-D144 WeakPolarHBondContact CD1-OD2 3.47Å; Y141-D144 HydrophobicContact CE1-CB 4.25Å; Y141-D144 VanDerWaalsContact CE1-CG 3.47Å; Y141-D144 WeakPolarHBondContact CE1-OD2 3.08Å; A142-D144 PolarHBondContact O-N 3.08Å; D144-E148 WeakPolarHBondContact O-CB 2.97Å; D144-E148 PolarHBondContact O-N 2.83Å; D144-R167 IonicContact OD1-CZ 2.82Å; D144-R167 IonicContact OD1-NH1 3.19Å; D144-R167 PolarHBondContact OD1-NH1 2.86Å; D144-R167 IonicContact OD1-NH2 2.87Å; D144-R167 PolarHBondContact OD1-NH2 2.99Å
145	C	94.4	Very high	90.9	Very high	7 Å²	7	65.9 Å²	65.9	5%	0.047	32%	0.324	C	S	.	.	H	α-helix	trans	-61.6	-49.1	174.7	-176.6	0	0	0	0	111.7	C106 H137 Y141 A142 D143 E148 R149	C106-C145 WeakPolarHBondContact SG-CB 3.47Å; C106-C145 PolarHBondContact SG-SG 2.89Å; H137-C145 WeakPolarHBondContact NE2-CB 3.47Å; H137-C145 PolarHBondContact NE2-SG 3.08Å; Y141-C145 PolarHBondContact O-N 3.4Å; A142-C145 WeakPolarHBondContact O-CB 3.41Å; A142-C145 PolarHBondContact O-N 3.33Å; A142-C145 VanDerWaalsContact O-N 3.12Å; D143-C145 VanDerWaalsContact C-N 3.35Å; C145-E148 PolarHBondContact O-N 3.41Å; C145-R149 VanDerWaalsContact O-CB 3.27Å; C145-R149 WeakPolarHBondContact O-CB 3.23Å; C145-R149 PolarHBondContact O-N 3.04Å
146	L	94.6	Very high	90.9	Very high	0 Å²	0	64.6 Å²	64.6	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-62.9	-45.7	-179.6	-70.4	175.1	0	0	0	110.3	L71 D73 T104 V107 A142 D143 E148 R149 C150 L164	L71-L146 HydrophobicContact CB-CD2 3.94Å; L71-L146 HydrophobicContact CD1-CD2 4.18Å; L71-L146 HydrophobicContact CG-CD2 4.49Å; D73-L146 HydrophobicContact CB-CD1 4.05Å; T104-L146 HydrophobicContact CG2-CD2 4.41Å; V107-L146 HydrophobicContact CG2-CD1 4.49Å; A142-L146 WeakPolarHBondContact O-CG 3.37Å; A142-L146 PolarHBondContact O-N 3.01Å; D143-L146 PolarHBondContact O-N 3.13Å; L146-E148 VanDerWaalsContact C-N 3.34Å; L146-E148 PolarHBondContact O-N 3.21Å; L146-R149 PolarHBondContact O-N 2.9Å; L146-C150 WeakPolarHBondContact O-CB 3.15Å; L146-C150 PolarHBondContact O-N 2.77Å; L146-C150 PolarHBondContact O-SG 3.46Å; L146-L164 HydrophobicContact CD1-CD2 3.8Å
147	V	93.7	Very high	91.2	Very high	20 Å²	20	55 Å²	55	12%	0.121	27%	0.271	C	S	.	.	H	α-helix	trans	-61.3	-42.1	177.9	169.5	0	0	0	0	111.8	D143 L164 R167 I168 I171	D143-V147 WeakPolarHBondContact O-CB 3.3Å; D143-V147 VanDerWaalsContact O-CG2 3.23Å; D143-V147 WeakPolarHBondContact O-CG2 3.41Å; D143-V147 PolarHBondContact O-N 3.42Å; V147-L164 HydrophobicContact CG2-CD1 3.68Å; V147-R167 HydrophobicContact CG2-CB 4.12Å; V147-I168 HydrophobicContact CG2-CG1 4.37Å; V147-I171 HydrophobicContact CG1-CD1 4.22Å
148	E	92.6	Very high	91.5	Very high	112 Å²	112	51.4 Å²	51.4	52%	0.523	25%	0.254	S	S	.	.	H	α-helix	trans	-66	-46	176.9	-166.5	61	-145.7	0	0	111.3	D144 C145 L146 C150 K151	D144-E148 WeakPolarHBondContact O-CB 2.97Å; D144-E148 PolarHBondContact O-N 2.83Å; C145-E148 PolarHBondContact O-N 3.41Å; L146-E148 VanDerWaalsContact C-N 3.34Å; L146-E148 PolarHBondContact O-N 3.21Å; E148-C150 VanDerWaalsContact C-N 3.3Å; E148-C150 PolarHBondContact O-N 3.05Å; E148-K151 VanDerWaalsContact O-CB 3.3Å; E148-K151 WeakPolarHBondContact O-CB 3.49Å; E148-K151 WeakPolarHBondContact O-CG 3.41Å; E148-K151 PolarHBondContact O-N 2.69Å; E148-K151 WeakPolarHBondContact OE1-CD 3.13Å; E148-K151 IonicContact OE1-NZ 2.75Å; E148-K151 PolarHBondContact OE1-NZ 2.78Å; E148-K151 VanDerWaalsContact OE2-CE 3.23Å; E148-K151 WeakPolarHBondContact OE2-CE 3.45Å; E148-K151 IonicContact OE2-NZ 3.39Å; E148-K151 PolarHBondContact OE2-NZ 2.87Å
149	R	92.2	Very high	91.8	Very high	56 Å²	56	39.3 Å²	39.3	21%	0.211	21%	0.208	C	C	.	.	H	α-helix	trans	-64.8	-34.3	-179	-168.6	174.7	-67.2	-95	4.6	112.2	L71 T134 C145 L146 K151 S152 Y155	L71-R149 HydrophobicContact CD1-CB 4.37Å; L71-R149 HydrophobicContact CD1-CG 4.1Å; T134-R149 PolarHBondContact O-NH2 2.94Å; C145-R149 VanDerWaalsContact O-CB 3.27Å; C145-R149 WeakPolarHBondContact O-CB 3.23Å; C145-R149 PolarHBondContact O-N 3.04Å; L146-R149 PolarHBondContact O-N 2.9Å; R149-K151 PolarHBondContact O-N 2.86Å; R149-S152 PolarHBondContact O-N 3.06Å; R149-S152 PolarHBondContact O-OG 2.87Å; R149-Y155 HydrophobicContact CG-CD2 4.19Å; R149-Y155 HydrophobicContact CG-CE2 3.87Å
150	C	90.2	Very high	92.1	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	19%	0.188	C	C	.	.	G	3₁₀ helix	trans	-70	-13.7	178.8	-68.6	0	0	0	0	114	L146 E148 S152 R153 V157 I171 V174	L146-C150 WeakPolarHBondContact O-CB 3.15Å; L146-C150 PolarHBondContact O-N 2.77Å; L146-C150 PolarHBondContact O-SG 3.46Å; E148-C150 VanDerWaalsContact C-N 3.3Å; E148-C150 PolarHBondContact O-N 3.05Å; C150-S152 PolarHBondContact O-N 2.79Å; C150-R153 PolarHBondContact O-N 3.05Å; C150-V157 HydrophobicContact CB-CG2 4.46Å; C150-V157 WeakPolarHBondContact SG-CG2 3.21Å; C150-I171 HydrophobicContact CB-CD1 4.36Å; C150-V174 HydrophobicContact CB-CG1 4.2Å; C150-V174 HydrophobicContact CB-CG2 4.29Å; C150-V174 WeakPolarHBondContact O-CG2 3.4Å
151	K	87.3	Confident	92.4	Very high	94 Å²	94	37.1 Å²	37.1	41%	0.409	18%	0.183	S	C	.	.	G	3₁₀ helix	trans	-61.2	-23.7	174.9	-67	179.3	-178.2	171.2	0	112.9	E148 R149 R153	E148-K151 VanDerWaalsContact O-CB 3.3Å; E148-K151 WeakPolarHBondContact O-CB 3.49Å; E148-K151 WeakPolarHBondContact O-CG 3.41Å; E148-K151 PolarHBondContact O-N 2.69Å; E148-K151 WeakPolarHBondContact OE1-CD 3.13Å; E148-K151 IonicContact OE1-NZ 2.75Å; E148-K151 PolarHBondContact OE1-NZ 2.78Å; E148-K151 VanDerWaalsContact OE2-CE 3.23Å; E148-K151 WeakPolarHBondContact OE2-CE 3.45Å; E148-K151 IonicContact OE2-NZ 3.39Å; E148-K151 PolarHBondContact OE2-NZ 2.87Å; R149-K151 PolarHBondContact O-N 2.86Å; K151-R153 PolarHBondContact O-N 2.84Å; K151-R153 PolarHBondContact O-NH1 3.22Å
152	S	86.2	Confident	92.6	Very high	56 Å²	56	40.1 Å²	40.1	39%	0.392	19%	0.193	S	C	.	.	G	3₁₀ helix	trans	-67.9	-13.3	173.7	67.2	0	0	0	0	113.6	R149 C150 C154	R149-S152 PolarHBondContact O-N 3.06Å; R149-S152 PolarHBondContact O-OG 2.87Å; C150-S152 PolarHBondContact O-N 2.79Å; S152-C154 PolarHBondContact O-N 3.46Å; S152-C154 VanDerWaalsContact O-N 3.09Å; S152-C154 PolarHBondContact OG-SG 2.81Å
153	R	87.3	Confident	92.7	Very high	41 Å²	41	44.4 Å²	44.4	16%	0.155	22%	0.216	C	C	.	.	S	Bend	trans	58.2	19.1	177	-64.8	168.9	173.2	80.2	-11.4	115	N61 C150 K151 T172 V174	N61-R153 PolarHBondContact ND2-O 3.25Å; C150-R153 PolarHBondContact O-N 3.05Å; K151-R153 PolarHBondContact O-N 2.84Å; K151-R153 PolarHBondContact O-NH1 3.22Å; R153-T172 PolarHBondContact NE-O 3.09Å; R153-V174 HydrophobicContact CG-CG2 4.35Å
154	C	89.2	Confident	92.8	Very high	55 Å²	55	43.1 Å²	43.1	37%	0.372	21%	0.209	S	C	.	.			trans	-104.7	5.6	176.1	59.3	0	0	0	0	113.8	S152	S152-C154 PolarHBondContact O-N 3.46Å; S152-C154 VanDerWaalsContact O-N 3.09Å; S152-C154 PolarHBondContact OG-SG 2.81Å
155	Y	93.6	Very high	92.9	Very high	37 Å²	37	40.8 Å²	40.8	15%	0.145	19%	0.194	C	C	.	.			trans	-120.3	147	-176.5	-62.4	-72.6	0	0	0	112	H69 L71 Y102 L133 R149	H69-Y155 HydrophobicContact CB-CD1 3.8Å; H69-Y155 HydrophobicContact CB-CE1 4.07Å; H69-Y155 CarbonylContact O-C 3.54Å; H69-Y155 WeakPolarHBondContact O-CA 3.38Å; L71-Y155 HydrophobicContact CD1-CD1 4.15Å; L71-Y155 HydrophobicContact CD1-CD2 3.93Å; L71-Y155 HydrophobicContact CD1-CG 3.65Å; L71-Y155 HydrophobicContact CD2-CD1 4.12Å; L71-Y155 HydrophobicContact CD2-CE1 4.29Å; L71-Y155 HydrophobicContact CD2-CG 4.43Å; L71-Y155 HydrophobicContact CG-CD1 3.8Å; L71-Y155 HydrophobicContact CG-CD2 4.47Å; L71-Y155 HydrophobicContact CG-CE1 4.46Å; L71-Y155 HydrophobicContact CG-CG 3.81Å; Y102-Y155 HydrophobicContact CD2-CE1 4.29Å; L133-Y155 HydrophobicContact CD1-CE1 4.43Å; R149-Y155 HydrophobicContact CG-CD2 4.19Å; R149-Y155 HydrophobicContact CG-CE2 3.87Å
156	I	93.9	Very high	92.9	Very high	1 Å²	1	47.6 Å²	47.6	1%	0.005	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	137.5	160.9	-59.7	175.2	0	0	0	107.2	Y68 H69 I70 L71 L95 P175 M177 I186	Y68-I156 HydrophobicContact CD1-CD1 3.88Å; Y68-I156 HydrophobicContact CG-CD1 4.02Å; H69-I156 PolarHBondContact O-N 2.63Å; I70-I156 CarbonylContact C-O 3.56Å; I70-I156 VanDerWaalsContact CA-O 3.3Å; I70-I156 WeakPolarHBondContact CA-O 3.47Å; I70-I156 HydrophobicContact CG1-CB 4.06Å; I70-I156 HydrophobicContact CG1-CD1 4.43Å; I70-I156 HydrophobicContact CG1-CG2 4.49Å; L71-I156 PolarHBondContact N-O 3.13Å; L95-I156 HydrophobicContact CD1-CD1 3.93Å; L95-I156 HydrophobicContact CD2-CD1 4.23Å; I156-P175 HydrophobicContact CG1-CB 4.08Å; I156-P175 HydrophobicContact CG1-CG 4.06Å; I156-P175 HydrophobicContact CG2-CB 4.22Å; I156-M177 HydrophobicContact CG2-CB 3.97Å; I156-I186 HydrophobicContact CD1-CD1 4.08Å; I156-I186 HydrophobicContact CG2-CD1 4.1Å
157	V	95.7	Very high	92.8	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	120.8	178.5	-169.9	0	0	0	0	110.7	C150 T159 I168 V174 P175 I176 M177	C150-V157 HydrophobicContact CB-CG2 4.46Å; C150-V157 WeakPolarHBondContact SG-CG2 3.21Å; V157-T159 HydrophobicContact CG1-CG2 3.95Å; V157-I168 HydrophobicContact CB-CD1 3.81Å; V157-I168 HydrophobicContact CG1-CD1 3.6Å; V157-I168 HydrophobicContact CG2-CD1 3.89Å; V157-I168 HydrophobicContact CG2-CG2 4.44Å; V157-V174 HydrophobicContact CG2-CG1 4Å; V157-P175 PolarHBondContact N-O 3.41Å; V157-I176 CarbonylContact O-C 3.59Å; V157-I176 WeakPolarHBondContact O-CA 3.49Å; V157-M177 PolarHBondContact O-N 3.1Å
158	A	96.3	Very high	92.8	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	98	172.6	0	0	0	0	0	109.8	I70 L71 L72 D73 Y76 M177	I70-A158 HydrophobicContact CG2-CB 3.82Å; L71-A158 WeakPolarHBondContact O-CB 3.35Å; L71-A158 PolarHBondContact O-N 3.23Å; L72-A158 HydrophobicContact CD2-CB 3.89Å; D73-A158 WeakPolarHBondContact CB-O 3.38Å; D73-A158 PolarHBondContact N-O 3.24Å; D73-A158 VanDerWaalsContact N-O 3.15Å; Y76-A158 VanDerWaalsContact CB-O 3.23Å; Y76-A158 WeakPolarHBondContact CB-O 3.5Å; Y76-A158 HydrophobicContact CD1-CB 3.81Å; Y76-A158 HydrophobicContact CD2-CB 3.77Å; Y76-A158 HydrophobicContact CE1-CB 3.97Å; Y76-A158 HydrophobicContact CE2-CB 3.93Å; Y76-A158 HydrophobicContact CG-CB 3.72Å; A158-M177 CarbonylContact C-O 3.56Å; A158-M177 VanDerWaalsContact CA-O 3.29Å; A158-M177 WeakPolarHBondContact CA-O 3.16Å; A158-M177 HydrophobicContact CB-CB 4.44Å; A158-M177 HydrophobicContact CB-CE 3.55Å
159	T	96.1	Very high	92.7	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	22%	0.218	C	C	.	.			trans	-143.6	140.7	178.6	-179	0	0	0	0	111.8	D73 V157 D161 L164 R165 I168 I176 M177 Y178	D73-T159 WeakPolarHBondContact OD2-CB 3.47Å; D73-T159 PolarHBondContact OD2-OG1 3.45Å; V157-T159 HydrophobicContact CG1-CG2 3.95Å; T159-D161 PolarHBondContact OG1-N 3.46Å; T159-D161 VanDerWaalsContact OG1-N 3.13Å; T159-L164 HydrophobicContact CG2-CD2 4.09Å; T159-L164 HydrophobicContact CG2-CG 4.19Å; T159-R165 HydrophobicContact CG2-CG 3.77Å; T159-I168 HydrophobicContact CG2-CD1 4.15Å; T159-I176 HydrophobicContact CG2-CG2 4.27Å; T159-M177 PolarHBondContact N-O 3.06Å; T159-Y178 VanDerWaalsContact O-CB 3.23Å; T159-Y178 WeakPolarHBondContact O-CB 3.38Å
160	C	94.1	Very high	92.6	Very high	23 Å²	23	55 Å²	55	16%	0.155	25%	0.245	C	C	.	.			trans	-101.8	-2.3	172.3	-65.8	0	0	0	0	112.6	F79 I179	F79-C160 HydrophobicContact CD2-CB 3.48Å; F79-C160 VanDerWaalsContact CD2-CB 3.48Å; F79-C160 HydrophobicContact CE2-CB 3.85Å; F79-C160 HydrophobicContact CG-CB 4.12Å; C160-I179 PolarHBondContact SG-N 3.38Å
161	D	95	Very high	92.5	Very high	39 Å²	39	56.2 Å²	56.2	21%	0.209	25%	0.251	C	S	.	.			trans	-74.7	133.9	179.2	177.7	34.8	0	0	0	111.5	T159 D163 L164 R165	T159-D161 PolarHBondContact OG1-N 3.46Å; T159-D161 VanDerWaalsContact OG1-N 3.13Å; D161-D163 PolarHBondContact OD1-N 3.21Å; D161-D163 PolarHBondContact OD2-N 2.84Å; D161-L164 HydrophobicContact CB-CB 4.1Å; D161-L164 WeakPolarHBondContact OD2-CB 3.48Å; D161-L164 PolarHBondContact OD2-N 3.25Å; D161-R165 VanDerWaalsContact O-CB 3.3Å; D161-R165 WeakPolarHBondContact O-CB 3.35Å; D161-R165 WeakPolarHBondContact O-CD 3.36Å; D161-R165 WeakPolarHBondContact O-CG 3.44Å; D161-R165 PolarHBondContact O-N 3.03Å; D161-R165 VanDerWaalsContact O-N 3.14Å
162	R	93.8	Very high	92.5	Very high	193 Å²	193	54.2 Å²	54.2	73%	0.728	25%	0.247	S	C	*	.	H	α-helix	trans	-70.7	-37.4	-177.5	-66.1	-177.6	178	-170	-1	111.4	R166	R162-R166 VanDerWaalsContact O-CG 3.31Å; R162-R166 WeakPolarHBondContact O-CG 3.38Å; R162-R166 PolarHBondContact O-N 3.48Å
163	D	95.2	Very high	92.5	Very high	90 Å²	90	52 Å²	52	48%	0.481	23%	0.233	S	C	.	.	H	α-helix	trans	-77.8	-43.1	-175	-69.6	-37.9	0	0	0	111.4	D161 R165 R166 R167	D161-D163 PolarHBondContact OD1-N 3.21Å; D161-D163 PolarHBondContact OD2-N 2.84Å; D163-R165 VanDerWaalsContact C-N 3.33Å; D163-R165 PolarHBondContact O-N 3.44Å; D163-R166 WeakPolarHBondContact O-CB 3.18Å; D163-R166 PolarHBondContact O-N 2.96Å; D163-R166 IonicContact OD1-CZ 3.02Å; D163-R166 IonicContact OD1-NH1 3.84Å; D163-R166 PolarHBondContact OD1-NH1 3.32Å; D163-R167 WeakPolarHBondContact O-CG 3.44Å; D163-R167 PolarHBondContact O-N 3.5Å
164	L	94.6	Very high	92.7	Very high	1 Å²	1	50 Å²	50	1%	0.005	23%	0.225	C	C	.	.	H	α-helix	trans	-59.4	-43.1	171	-174.7	55.1	0	0	0	111.7	D143 L146 V147 T159 D161 R166 R167 I168	D143-L164 HydrophobicContact CB-CD1 4.14Å; L146-L164 HydrophobicContact CD1-CD2 3.8Å; V147-L164 HydrophobicContact CG2-CD1 3.68Å; T159-L164 HydrophobicContact CG2-CD2 4.09Å; T159-L164 HydrophobicContact CG2-CG 4.19Å; D161-L164 HydrophobicContact CB-CB 4.1Å; D161-L164 WeakPolarHBondContact OD2-CB 3.48Å; D161-L164 PolarHBondContact OD2-N 3.25Å; L164-R166 PolarHBondContact O-N 2.65Å; L164-R167 WeakPolarHBondContact O-CB 3.44Å; L164-R167 PolarHBondContact O-N 3.49Å; L164-R167 VanDerWaalsContact O-N 3.13Å; L164-I168 HydrophobicContact CD1-CD1 3.9Å; L164-I168 HydrophobicContact CD1-CG1 4.17Å; L164-I168 HydrophobicContact CD2-CD1 4.39Å; L164-I168 HydrophobicContact CG-CD1 3.7Å; L164-I168 HydrophobicContact CG-CG1 4.42Å; L164-I168 WeakPolarHBondContact O-CG1 3.3Å; L164-I168 PolarHBondContact O-N 3.39Å
165	R	94.4	Very high	92.9	Very high	32 Å²	32	47.7 Å²	47.7	12%	0.121	21%	0.209	C	C	.	.	H	α-helix	trans	-58.9	-44	174	-74.3	178.1	65.9	180	5.2	112.4	T159 D161 D163 R167 I168 R169 I176 Y178 E187	T159-R165 HydrophobicContact CG2-CG 3.77Å; D161-R165 VanDerWaalsContact O-CB 3.3Å; D161-R165 WeakPolarHBondContact O-CB 3.35Å; D161-R165 WeakPolarHBondContact O-CD 3.36Å; D161-R165 WeakPolarHBondContact O-CG 3.44Å; D161-R165 PolarHBondContact O-N 3.03Å; D161-R165 VanDerWaalsContact O-N 3.14Å; D163-R165 VanDerWaalsContact C-N 3.33Å; D163-R165 PolarHBondContact O-N 3.44Å; R165-R167 VanDerWaalsContact C-N 3.28Å; R165-R167 PolarHBondContact O-N 3.39Å; R165-I168 PolarHBondContact O-N 3.23Å; R165-R169 WeakPolarHBondContact O-CB 3.02Å; R165-R169 VanDerWaalsContact O-CG 3.26Å; R165-R169 WeakPolarHBondContact O-CG 3.38Å; R165-R169 PolarHBondContact O-N 3.36Å; R165-I176 HydrophobicContact CB-CD1 4.46Å; R165-I176 HydrophobicContact CG-CG2 3.77Å; R165-Y178 VanDerWaalsContact NH1-CG 3.3Å; R165-Y178 VanDerWaalsContact NH2-CD1 3.32Å; R165-E187 IonicContact CZ-OE2 2.69Å; R165-E187 IonicContact NE-OE2 2.81Å; R165-E187 IonicContact NH2-OE2 2.9Å; R165-E187 PolarHBondContact NH2-OE2 3.41Å
166	R	94	Very high	92.9	Very high	149 Å²	149	45.9 Å²	45.9	56%	0.562	20%	0.202	S	C	*	.	H	α-helix	trans	-60	-38.9	175.8	-75.6	168.2	179	164.2	-6.3	111.9	R162 D163 L164	R162-R166 VanDerWaalsContact O-CG 3.31Å; R162-R166 WeakPolarHBondContact O-CG 3.38Å; R162-R166 PolarHBondContact O-N 3.48Å; D163-R166 WeakPolarHBondContact O-CB 3.18Å; D163-R166 PolarHBondContact O-N 2.96Å; D163-R166 IonicContact OD1-CZ 3.02Å; D163-R166 IonicContact OD1-NH1 3.84Å; D163-R166 PolarHBondContact OD1-NH1 3.32Å; L164-R166 PolarHBondContact O-N 2.65Å
167	R	94.2	Very high	92.9	Very high	80 Å²	80	45.9 Å²	45.9	30%	0.302	20%	0.202	S	C	.	.	H	α-helix	trans	-67.2	-48.1	176.7	-69	177.1	61.1	174.9	-0.8	111.7	D144 V147 D163 L164 R165 R169 K170	D144-R167 IonicContact OD1-CZ 2.82Å; D144-R167 IonicContact OD1-NH1 3.19Å; D144-R167 PolarHBondContact OD1-NH1 2.86Å; D144-R167 IonicContact OD1-NH2 2.87Å; D144-R167 PolarHBondContact OD1-NH2 2.99Å; V147-R167 HydrophobicContact CG2-CB 4.12Å; D163-R167 WeakPolarHBondContact O-CG 3.44Å; D163-R167 PolarHBondContact O-N 3.5Å; L164-R167 WeakPolarHBondContact O-CB 3.44Å; L164-R167 PolarHBondContact O-N 3.49Å; L164-R167 VanDerWaalsContact O-N 3.13Å; R165-R167 VanDerWaalsContact C-N 3.28Å; R165-R167 PolarHBondContact O-N 3.39Å; R167-R169 VanDerWaalsContact C-N 3.31Å; R167-R169 PolarHBondContact O-N 3.12Å; R167-K170 WeakPolarHBondContact O-CB 3.35Å; R167-K170 PolarHBondContact O-N 3.07Å; R167-K170 VanDerWaalsContact O-N 3.13Å
168	I	93	Very high	92.8	Very high	0 Å²	0	47 Å²	47	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-66	-34.2	-179.2	-63.4	162.5	0	0	0	111.2	V147 V157 T159 L164 R165 K170 I171 V174 I176	V147-I168 HydrophobicContact CG2-CG1 4.37Å; V157-I168 HydrophobicContact CB-CD1 3.81Å; V157-I168 HydrophobicContact CG1-CD1 3.6Å; V157-I168 HydrophobicContact CG2-CD1 3.89Å; V157-I168 HydrophobicContact CG2-CG2 4.44Å; T159-I168 HydrophobicContact CG2-CD1 4.15Å; L164-I168 HydrophobicContact CD1-CD1 3.9Å; L164-I168 HydrophobicContact CD1-CG1 4.17Å; L164-I168 HydrophobicContact CD2-CD1 4.39Å; L164-I168 HydrophobicContact CG-CD1 3.7Å; L164-I168 HydrophobicContact CG-CG1 4.42Å; L164-I168 WeakPolarHBondContact O-CG1 3.3Å; L164-I168 PolarHBondContact O-N 3.39Å; R165-I168 PolarHBondContact O-N 3.23Å; I168-K170 PolarHBondContact O-N 3.26Å; I168-K170 VanDerWaalsContact O-N 3.12Å; I168-I171 WeakPolarHBondContact O-CA 3.4Å; I168-I171 WeakPolarHBondContact O-CB 3.38Å; I168-I171 PolarHBondContact O-N 3.45Å; I168-V174 HydrophobicContact CG2-CB 4.16Å; I168-V174 HydrophobicContact CG2-CG1 3.66Å; I168-I176 HydrophobicContact CB-CD1 4Å; I168-I176 HydrophobicContact CB-CG1 4.31Å; I168-I176 HydrophobicContact CG2-CD1 3.86Å; I168-I176 HydrophobicContact CG2-CG1 3.7Å
169	R	91	Very high	92.7	Very high	86 Å²	86	48 Å²	48	33%	0.325	21%	0.211	S	C	.	.	H	α-helix	trans	-58.9	-24.1	174.3	-78.3	-179.1	-167.8	114.6	0.4	113.9	R165 R167 I171 I176 E187 K188	R165-R169 WeakPolarHBondContact O-CB 3.02Å; R165-R169 VanDerWaalsContact O-CG 3.26Å; R165-R169 WeakPolarHBondContact O-CG 3.38Å; R165-R169 PolarHBondContact O-N 3.36Å; R167-R169 VanDerWaalsContact C-N 3.31Å; R167-R169 PolarHBondContact O-N 3.12Å; R169-I171 VanDerWaalsContact C-N 3.25Å; R169-I176 HydrophobicContact CG-CD1 3.73Å; R169-E187 WeakPolarHBondContact CD-OE1 3.37Å; R169-E187 IonicContact CZ-OE1 2.7Å; R169-E187 IonicContact CZ-OE2 2.75Å; R169-E187 IonicContact NE-OE1 3.62Å; R169-E187 PolarHBondContact NE-OE1 3.15Å; R169-E187 IonicContact NE-OE2 2.8Å; R169-E187 PolarHBondContact NE-OE2 2.83Å; R169-E187 IonicContact NH2-OE1 3.64Å; R169-E187 IonicContact NH2-OE2 3.53Å; R169-E187 PolarHBondContact NH2-OE2 3.18Å; R169-K188 PolarHBondContact O-NZ 2.62Å
170	K	90.6	Very high	92.4	Very high	178 Å²	178	53.1 Å²	53.1	77%	0.774	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.9	-22.1	174.5	-61.2	178.5	-179.2	-178.3	0	112.2	R167 I168	R167-K170 WeakPolarHBondContact O-CB 3.35Å; R167-K170 PolarHBondContact O-N 3.07Å; R167-K170 VanDerWaalsContact O-N 3.13Å; I168-K170 PolarHBondContact O-N 3.26Å; I168-K170 VanDerWaalsContact O-N 3.12Å
171	I	87.8	Confident	92.1	Very high	25 Å²	25	54.2 Å²	54.2	13%	0.128	25%	0.25	C	S	.	.	S	Bend	trans	-84	126.9	174.9	-51.3	175.9	0	0	0	108.2	V147 C150 I168 R169 V174 K188	V147-I171 HydrophobicContact CG1-CD1 4.22Å; C150-I171 HydrophobicContact CB-CD1 4.36Å; I168-I171 WeakPolarHBondContact O-CA 3.4Å; I168-I171 WeakPolarHBondContact O-CB 3.38Å; I168-I171 PolarHBondContact O-N 3.45Å; R169-I171 VanDerWaalsContact C-N 3.25Å; I171-V174 HydrophobicContact CB-CG2 4.3Å; I171-V174 HydrophobicContact CG2-CG2 3.66Å; I171-K188 PolarHBondContact O-NZ 2.7Å
172	T	87	Confident	91.7	Very high	53 Å²	53	59.6 Å²	59.6	33%	0.325	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.5	140	177.2	50.6	0	0	0	0	110.7	L56 R153	L56-T172 VanDerWaalsContact CD2-OG1 3.29Å; L56-T172 WeakPolarHBondContact CD2-OG1 3.17Å; R153-T172 PolarHBondContact NE-O 3.09Å
173	G	86.8	Confident	91.5	Very high	9 Å²	9	57.1 Å²	57.1	9%	0.093	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	79.6	9.7	176.7	0	0	0	0	0	116.7	S59 N61 L64	S59-G173 PolarHBondContact O-N 2.89Å; N61-G173 PolarHBondContact ND2-O 2.83Å; N61-G173 VanDerWaalsContact ND2-O 3.11Å; L64-G173 WeakPolarHBondContact CD1-O 3.33Å
174	V	90.8	Very high	91.3	Very high	0 Å²	0	53.6 Å²	53.6	0%	0	25%	0.246	C	C	.	.			trans	-108.4	111.9	176.8	-179.6	0	0	0	0	110.1	C150 R153 V157 I168 I171	C150-V174 HydrophobicContact CB-CG1 4.2Å; C150-V174 HydrophobicContact CB-CG2 4.29Å; C150-V174 WeakPolarHBondContact O-CG2 3.4Å; R153-V174 HydrophobicContact CG-CG2 4.35Å; V157-V174 HydrophobicContact CG2-CG1 4Å; I168-V174 HydrophobicContact CG2-CB 4.16Å; I168-V174 HydrophobicContact CG2-CG1 3.66Å; I171-V174 HydrophobicContact CB-CG2 4.3Å; I171-V174 HydrophobicContact CG2-CG2 3.66Å
175	P	92.2	Very high	91.2	Very high	5 Å²	5	53.6 Å²	53.6	3%	0.032	25%	0.246	C	C	.	.			trans	-71.8	149.4	174	-17.9	32.3	0	0	0	112.1	L64 I156 V157 I186 E187 M189	L64-P175 VanDerWaalsContact CD1-CD 3.43Å; L64-P175 HydrophobicContact CD1-CG 3.69Å; I156-P175 HydrophobicContact CG1-CB 4.08Å; I156-P175 HydrophobicContact CG1-CG 4.06Å; I156-P175 HydrophobicContact CG2-CB 4.22Å; V157-P175 PolarHBondContact N-O 3.41Å; P175-I186 HydrophobicContact CB-CD1 3.91Å; P175-I186 HydrophobicContact CB-CG1 4.12Å; P175-E187 WeakPolarHBondContact CA-O 3.35Å; P175-M189 HydrophobicContact CB-CB 4.41Å
176	I	94.1	Very high	91	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	120.4	179.6	-54.7	175.4	0	0	0	108.5	V157 T159 R165 I168 R169 I186 E187	V157-I176 CarbonylContact O-C 3.59Å; V157-I176 WeakPolarHBondContact O-CA 3.49Å; T159-I176 HydrophobicContact CG2-CG2 4.27Å; R165-I176 HydrophobicContact CB-CD1 4.46Å; R165-I176 HydrophobicContact CG-CG2 3.77Å; I168-I176 HydrophobicContact CB-CD1 4Å; I168-I176 HydrophobicContact CB-CG1 4.31Å; I168-I176 HydrophobicContact CG2-CD1 3.86Å; I168-I176 HydrophobicContact CG2-CG1 3.7Å; R169-I176 HydrophobicContact CG-CD1 3.73Å; I176-I186 CarbonylContact O-C 3.55Å; I176-I186 WeakPolarHBondContact O-CA 3.43Å; I176-E187 HydrophobicContact CB-CB 4.25Å; I176-E187 PolarHBondContact N-O 3.16Å; I176-E187 VanDerWaalsContact N-O 3.1Å; I176-E187 PolarHBondContact O-N 3.42Å
177	M	93.9	Very high	90.7	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	133	173.8	-171.1	171.4	68.4	0	0	110	I70 Y76 T91 I156 V157 A158 T159 V184 V185	I70-M177 HydrophobicContact CD1-CE 4.17Å; I70-M177 HydrophobicContact CG2-CE 3.66Å; Y76-M177 HydrophobicContact CE1-CE 4.34Å; Y76-M177 HydrophobicContact CE2-CE 4.35Å; Y76-M177 HydrophobicContact CE2-CG 4.43Å; Y76-M177 WeakPolarHBondContact OH-CE 3.41Å; T91-M177 HydrophobicContact CG2-CE 3.89Å; T91-M177 HydrophobicContact CG2-SD 3.99Å; I156-M177 HydrophobicContact CG2-CB 3.97Å; V157-M177 PolarHBondContact O-N 3.1Å; A158-M177 CarbonylContact C-O 3.56Å; A158-M177 VanDerWaalsContact CA-O 3.29Å; A158-M177 WeakPolarHBondContact CA-O 3.16Å; A158-M177 HydrophobicContact CB-CB 4.44Å; A158-M177 HydrophobicContact CB-CE 3.55Å; T159-M177 PolarHBondContact N-O 3.06Å; M177-V184 HydrophobicContact CG-CG1 3.23Å; M177-V184 HydrophobicContact SD-CG1 3.44Å; M177-V184 WeakPolarHBondContact SD-CG1 3.35Å; M177-V185 CarbonylContact C-O 3.58Å; M177-V185 WeakPolarHBondContact CA-O 3.22Å
178	Y	94.6	Very high	90	Very high	25 Å²	25	46.8 Å²	46.8	10%	0.098	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	161.9	-179.4	66.8	-81.8	0	0	0	110.8	T159 R165 H180 V185 E187	T159-Y178 VanDerWaalsContact O-CB 3.23Å; T159-Y178 WeakPolarHBondContact O-CB 3.38Å; R165-Y178 VanDerWaalsContact NH1-CG 3.3Å; R165-Y178 VanDerWaalsContact NH2-CD1 3.32Å; Y178-H180 HydrophobicContact CD2-CB 4.41Å; Y178-H180 HydrophobicContact CE2-CB 4.05Å; Y178-V185 WeakPolarHBondContact CD1-O 3.16Å; Y178-V185 HydrophobicContact CE1-CB 4.06Å; Y178-V185 HydrophobicContact CE1-CG1 3.78Å; Y178-V185 HydrophobicContact CE2-CB 4.2Å; Y178-V185 HydrophobicContact CE2-CG1 4.37Å; Y178-V185 PolarHBondContact N-O 2.88Å; Y178-V185 PolarHBondContact O-N 3.32Å; Y178-V185 VanDerWaalsContact O-O 3.12Å; Y178-V185 WeakPolarHBondContact OH-CG1 3.42Å; Y178-E187 HydrophobicContact CE1-CB 4.29Å
179	I	93.5	Very high	89.3	Confident	19 Å²	19	47.9 Å²	47.9	10%	0.097	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	130.7	-179	-53.3	177.9	0	0	0	109	Y76 F79 S80 N83 L85 C160 V184	Y76-I179 HydrophobicContact CD2-CD1 4.29Å; Y76-I179 HydrophobicContact CD2-CG1 4.07Å; Y76-I179 HydrophobicContact CE2-CD1 4.02Å; Y76-I179 HydrophobicContact CE2-CG1 3.56Å; F79-I179 HydrophobicContact CB-CD1 3.95Å; S80-I179 WeakPolarHBondContact OG-CD1 3.23Å; N83-I179 VanDerWaalsContact ND2-CG2 3.31Å; N83-I179 WeakPolarHBondContact ND2-CG2 3.23Å; L85-I179 HydrophobicContact CD1-CD1 4.36Å; L85-I179 HydrophobicContact CD1-CG2 3.67Å; C160-I179 PolarHBondContact SG-N 3.38Å; I179-V184 HydrophobicContact CG1-CG2 4.39Å
180	H	90.7	Very high	88.3	Confident	109 Å²	109	48 Å²	48	51%	0.505	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	111	174.1	-173	80.5	0	0	0	109.6	Y178 H182 R183 V185	Y178-H180 HydrophobicContact CD2-CB 4.41Å; Y178-H180 HydrophobicContact CE2-CB 4.05Å; H180-H182 PolarHBondContact O-N 3.24Å; H180-R183 PolarHBondContact N-O 3.34Å; H180-R183 VanDerWaalsContact O-CG 3.27Å; H180-R183 WeakPolarHBondContact O-CG 3.39Å; H180-R183 PolarHBondContact O-N 3.44Å; H180-V185 HydrophobicContact CB-CG2 4.01Å
181	G	86.4	Confident	87	Confident	46 Å²	46	46.1 Å²	46.1	47%	0.474	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	63.2	-128.6	-169.6	0	0	0	0	0	111.1	N83	N83-G181 PolarHBondContact ND2-O 2.78Å
182	H	87.7	Confident	85.7	Confident	152 Å²	152	46 Å²	46	70%	0.704	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-98.9	20	178.4	-62.3	-75.5	0	0	0	113.5	L85 H180	L85-H182 WeakPolarHBondContact CD2-O 3.29Å; H180-H182 PolarHBondContact O-N 3.24Å
183	R	88.8	Confident	84.3	Confident	141 Å²	141	51 Å²	51	53%	0.532	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	150.7	178	61.9	177.4	-178.5	-172.5	1.1	112	H180 V185	H180-R183 PolarHBondContact N-O 3.34Å; H180-R183 VanDerWaalsContact O-CG 3.27Å; H180-R183 WeakPolarHBondContact O-CG 3.39Å; H180-R183 PolarHBondContact O-N 3.44Å; R183-V185 HydrophobicContact CG-CG2 4.17Å
184	V	91.9	Very high	82.7	Confident	15 Å²	15	52.5 Å²	52.5	9%	0.091	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	137	168.8	177.7	0	0	0	0	108	Y76 L85 C94 M177 I179	Y76-V184 WeakPolarHBondContact OH-CG2 3.38Å; L85-V184 HydrophobicContact CD1-CG2 4.48Å; C94-V184 HydrophobicContact CB-CB 4.1Å; C94-V184 HydrophobicContact CB-CG1 3.97Å; M177-V184 HydrophobicContact CG-CG1 3.23Å; M177-V184 HydrophobicContact SD-CG1 3.44Å; M177-V184 WeakPolarHBondContact SD-CG1 3.35Å; I179-V184 HydrophobicContact CG1-CG2 4.39Å
185	V	91.5	Very high	81	Confident	1 Å²	1	55 Å²	55	1%	0.006	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	141	-178.1	177.5	0	0	0	0	107.8	M177 Y178 H180 R183 P196	M177-V185 CarbonylContact C-O 3.58Å; M177-V185 WeakPolarHBondContact CA-O 3.22Å; Y178-V185 WeakPolarHBondContact CD1-O 3.16Å; Y178-V185 HydrophobicContact CE1-CB 4.06Å; Y178-V185 HydrophobicContact CE1-CG1 3.78Å; Y178-V185 HydrophobicContact CE2-CB 4.2Å; Y178-V185 HydrophobicContact CE2-CG1 4.37Å; Y178-V185 PolarHBondContact N-O 2.88Å; Y178-V185 PolarHBondContact O-N 3.32Å; Y178-V185 VanDerWaalsContact O-O 3.12Å; Y178-V185 WeakPolarHBondContact OH-CG1 3.42Å; H180-V185 HydrophobicContact CB-CG2 4.01Å; R183-V185 HydrophobicContact CG-CG2 4.17Å; V185-P196 HydrophobicContact CG1-CG 4.31Å
186	I	91.1	Very high	79.1	Confident	2 Å²	2	57.4 Å²	57.4	1%	0.01	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	137.8	175.8	-170.6	162.9	0	0	0	111.2	L95 I156 P175 I176 M189 A192 A195	L95-I186 HydrophobicContact CD2-CD1 3.6Å; I156-I186 HydrophobicContact CD1-CD1 4.08Å; I156-I186 HydrophobicContact CG2-CD1 4.1Å; P175-I186 HydrophobicContact CB-CD1 3.91Å; P175-I186 HydrophobicContact CB-CG1 4.12Å; I176-I186 CarbonylContact O-C 3.55Å; I176-I186 WeakPolarHBondContact O-CA 3.43Å; I186-M189 HydrophobicContact CD1-CB 4.16Å; I186-M189 HydrophobicContact CD1-SD 3.62Å; I186-M189 HydrophobicContact CG1-CB 4.2Å; I186-A192 HydrophobicContact CG2-CB 3.16Å; I186-A195 WeakPolarHBondContact O-CB 3.29Å
187	E	87.9	Confident	77	Confident	30 Å²	30	67.4 Å²	67.4	14%	0.14	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	152.6	176.7	-160.1	-174.2	136.2	0	0	109.3	R165 R169 P175 I176 Y178 M189	R165-E187 IonicContact CZ-OE2 2.69Å; R165-E187 IonicContact NE-OE2 2.81Å; R165-E187 IonicContact NH2-OE2 2.9Å; R165-E187 PolarHBondContact NH2-OE2 3.41Å; R169-E187 WeakPolarHBondContact CD-OE1 3.37Å; R169-E187 IonicContact CZ-OE1 2.7Å; R169-E187 IonicContact CZ-OE2 2.75Å; R169-E187 IonicContact NE-OE1 3.62Å; R169-E187 PolarHBondContact NE-OE1 3.15Å; R169-E187 IonicContact NE-OE2 2.8Å; R169-E187 PolarHBondContact NE-OE2 2.83Å; R169-E187 IonicContact NH2-OE1 3.64Å; R169-E187 IonicContact NH2-OE2 3.53Å; R169-E187 PolarHBondContact NH2-OE2 3.18Å; P175-E187 WeakPolarHBondContact CA-O 3.35Å; I176-E187 HydrophobicContact CB-CB 4.25Å; I176-E187 PolarHBondContact N-O 3.16Å; I176-E187 VanDerWaalsContact N-O 3.1Å; I176-E187 PolarHBondContact O-N 3.42Å; Y178-E187 HydrophobicContact CE1-CB 4.29Å; E187-M189 VanDerWaalsContact C-N 3.29Å; E187-M189 PolarHBondContact O-N 2.94Å
188	K	79.6	Confident	74.6	Confident	86 Å²	86	78 Å²	78	37%	0.374	41%	0.414	S	S	.	.	S	Bend	trans	59.2	31.6	176.2	-62.6	-170.9	167.5	-159.7	0	115.5	R169 I171	R169-K188 PolarHBondContact O-NZ 2.62Å; I171-K188 PolarHBondContact O-NZ 2.7Å
189	M	76.6	Confident	73.6	Confident	23 Å²	23	80.6 Å²	80.6	11%	0.113	43%	0.43	C	S	.	.			trans	-121.1	112.6	170.2	-171.6	174.2	-178.3	0	0	108.7	Y68 L95 P175 I186 E187 M191 A192	Y68-M189 HydrophobicContact CE1-CE 3.66Å; Y68-M189 HydrophobicContact CE2-CE 4.11Å; Y68-M189 WeakPolarHBondContact OH-CE 3.25Å; L95-M189 HydrophobicContact CD2-CE 4.08Å; L95-M189 HydrophobicContact CD2-SD 3.61Å; P175-M189 HydrophobicContact CB-CB 4.41Å; I186-M189 HydrophobicContact CD1-CB 4.16Å; I186-M189 HydrophobicContact CD1-SD 3.62Å; I186-M189 HydrophobicContact CG1-CB 4.2Å; E187-M189 VanDerWaalsContact C-N 3.29Å; E187-M189 PolarHBondContact O-N 2.94Å; M189-M191 PolarHBondContact O-N 3.13Å; M189-A192 HydrophobicContact CB-CB 3.79Å; M189-A192 HydrophobicContact CG-CB 3.97Å; M189-A192 PolarHBondContact O-N 3.19Å; M189-A192 HydrophobicContact SD-CB 4.07Å
190	P	69.8	Low	72.5	Confident	90 Å²	90	83.8 Å²	83.8	58%	0.584	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69	-21.9	-174.4	30.2	-35.7	0	0	0	112.7	Y60	Y60-P190 HydrophobicContact CD1-CG 4.18Å; Y60-P190 HydrophobicContact CD2-CB 4.47Å; Y60-P190 HydrophobicContact CD2-CG 3.21Å; Y60-P190 HydrophobicContact CE1-CG 3.93Å; Y60-P190 HydrophobicContact CE2-CB 4.45Å; Y60-P190 HydrophobicContact CE2-CG 2.97Å; Y60-P190 HydrophobicContact CG-CG 3.83Å
191	M	64.3	Low	71.5	Confident	137 Å²	137	82.4 Å²	82.4	68%	0.675	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.6	-5.1	177.6	-62.4	-175.9	70.9	0	0	113.5	M189 L193	M189-M191 PolarHBondContact O-N 3.13Å; M191-L193 PolarHBondContact O-N 3.08Å
192	A	60.7	Low	70.6	Confident	23 Å²	23	84.6 Å²	84.6	19%	0.19	44%	0.443	C	S	.	.			trans	-81.8	110.4	-171.7	0	0	0	0	0	112.8	I186 M189 G194	I186-A192 HydrophobicContact CG2-CB 3.16Å; M189-A192 HydrophobicContact CB-CB 3.79Å; M189-A192 HydrophobicContact CG-CB 3.97Å; M189-A192 PolarHBondContact O-N 3.19Å; M189-A192 HydrophobicContact SD-CB 4.07Å; A192-G194 PolarHBondContact O-N 3.37Å
193	L	56.7	Low	69.6	Low	159 Å²	159	80.4 Å²	80.4	83%	0.832	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.9	84.2	168.1	-70.3	151.5	0	0	0	109.4	M191	M191-L193 PolarHBondContact O-N 3.08Å
194	G	53.8	Low	68.3	Low	40 Å²	40	76.3 Å²	76.3	41%	0.412	42%	0.42	S	S	.	.	T	Hydrogen-bonded Turn	trans	165.1	-8.3	175.5	0	0	0	0	0	117.5	A192 P196	A192-G194 PolarHBondContact O-N 3.37Å; G194-P196 WeakPolarHBondContact O-CD 3.43Å
195	A	55	Low	66.6	Low	53 Å²	53	80.7 Å²	80.7	44%	0.438	44%	0.443	S	S	.	.			trans	-64.9	123.7	172.5	0	0	0	0	0	109.6	I186 K197	I186-A195 WeakPolarHBondContact O-CB 3.29Å; A195-K197 PolarHBondContact O-N 2.96Å
196	P	52.3	Low	64.7	Low	55 Å²	55	86.8 Å²	86.8	36%	0.357	48%	0.477	S	S	.	.			trans	-57.8	128.6	163.8	25.7	-29.7	0	0	0	106.8	V185 G194 L198	V185-P196 HydrophobicContact CG1-CG 4.31Å; G194-P196 WeakPolarHBondContact O-CD 3.43Å; P196-L198 PolarHBondContact O-N 3.1Å
197	K	51	Low	62.5	Low	210 Å²	210	93.9 Å²	93.9	91%	0.913	52%	0.516	S	S	*	.			trans	-57.6	111.7	166	-63.2	-177.5	-178.4	-179.7	0	105.4	A195	A195-K197 PolarHBondContact O-N 2.96Å
198	L	42.3	Very low	60.2	Low	221 Å²	221	99.7 Å²	99.7	100%	1.157	55%	0.55	S	S	*	.			trans	-57.8	0	169.9	-82.1	162.6	0	0	0	109.5	P196	P196-L198 PolarHBondContact O-N 3.1Å

Retrieved 198 of 198 residues in 440.6 ms (Link to these results)

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