A0A077ZAZ0_TRITR Loading...

Cytochrome b-c1 complex subunit Rieske, mitochondrial

AlphaFold DB , UniProt , Accession A0A077ZAZ0, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 246 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	41.3	Very low	38.1	Very low	239 Å²	239	148.7 Å²	148.7	100%	1.177	84%	0.835	S	S	*	*				0	125.8	0	-63.9	-158.2	179.3	0	0	107.8
2	P	40.1	Very low	37.8	Very low	132 Å²	132	148.3 Å²	148.3	86%	0.857	83%	0.83	S	S	*	*			trans	-89.5	145.5	-160.7	30.2	-22	0	0	0	113
3	N	40.4	Very low	37.5	Very low	155 Å²	155	153.1 Å²	153.1	83%	0.829	83%	0.829	S	S	*	*			trans	-86.3	137.4	-179.7	-175.2	15.7	0	0	0	110.9
4	P	44.7	Very low	37.3	Very low	101 Å²	101	150.9 Å²	150.9	66%	0.656	82%	0.823	S	S	*	*			trans	-112.3	121.3	161.1	27.8	-11.6	0	0	0	112.3
5	S	36.6	Very low	37.2	Very low	118 Å²	118	146.2 Å²	146.2	83%	0.825	81%	0.813	S	S	*	*			trans	-12.1	127.8	152.9	49.5	0	0	0	0	117.3
6	T	41.6	Very low	37	Very low	137 Å²	137	148 Å²	148	84%	0.84	81%	0.81	S	S	*	*			trans	-108.7	116.5	165.4	20.5	0	0	0	0	110.4
7	E	34.1	Very low	36.9	Very low	196 Å²	196	145 Å²	145	92%	0.916	81%	0.809	S	S	*	*			trans	-77.2	125.2	174	-159.1	178.1	-174.6	0	0	109
8	I	36.9	Very low	36.7	Very low	143 Å²	143	145.1 Å²	145.1	73%	0.733	81%	0.807	S	S	*	*			trans	-91.6	105.2	179.5	-65.2	171.8	0	0	0	108.3
9	A	37	Very low	36.4	Very low	92 Å²	92	147.2 Å²	147.2	76%	0.76	81%	0.808	S	S	*	*			trans	-88.7	110.4	167	0	0	0	0	0	110	L11	A9-L11 PolarHBondContact O-N 2.96Å
10	H	33.2	Very low	36.4	Very low	157 Å²	157	144.2 Å²	144.2	73%	0.727	80%	0.803	S	S	*	*			trans	-71.3	116	169.9	-85	-94.5	0	0	0	110.6
11	L	33.5	Very low	36.2	Very low	166 Å²	166	143 Å²	143	87%	0.869	80%	0.799	S	S	*	*			trans	-106.7	97.5	164.8	-96.7	156.3	0	0	0	108.9	A9 Y13	A9-L11 PolarHBondContact O-N 2.96Å; L11-Y13 PolarHBondContact O-N 2.92Å
12	N	34.1	Very low	35.7	Very low	143 Å²	143	135.6 Å²	135.6	77%	0.765	77%	0.771	S	S	*	*			trans	-77.2	105.8	167.8	-76.9	-30.8	0	0	0	108.9
13	Y	33.8	Very low	35.2	Very low	211 Å²	211	134.9 Å²	134.9	83%	0.827	77%	0.768	S	S	*	*			trans	-101.2	94.9	166.7	-159.6	-94.8	0	0	0	108.8	L11 A15	L11-Y13 PolarHBondContact O-N 2.92Å; Y13-A15 HydrophobicContact CD1-CB 4.28Å; Y13-A15 HydrophobicContact CE1-CB 4.08Å
14	V	35.1	Very low	34.8	Very low	122 Å²	122	132.1 Å²	132.1	74%	0.739	76%	0.757	S	S	*	*			trans	-88.5	101.1	169.6	177	0	0	0	0	107.5	K16	V14-K16 HydrophobicContact CG1-CG 4.41Å; V14-K16 PolarHBondContact O-N 2.81Å
15	A	35.9	Very low	34.6	Very low	81 Å²	81	134.4 Å²	134.4	67%	0.669	76%	0.762	S	S	*	*			trans	-85.3	100.9	165.7	0	0	0	0	0	108.7	Y13	Y13-A15 HydrophobicContact CD1-CB 4.28Å; Y13-A15 HydrophobicContact CE1-CB 4.08Å
16	K	33.2	Very low	34.6	Very low	175 Å²	175	134.5 Å²	134.5	76%	0.761	76%	0.758	S	S	*	*			trans	-77.9	113.5	162.4	-88.5	-179.5	172.9	-178.8	0	108.3	V14	V14-K16 HydrophobicContact CG1-CG 4.41Å; V14-K16 PolarHBondContact O-N 2.81Å
17	A	35.7	Very low	34.5	Very low	97 Å²	97	132.7 Å²	132.7	80%	0.802	75%	0.751	S	S	*	*			trans	-91.4	96.2	164.9	0	0	0	0	0	108.2	F19	A17-F19 PolarHBondContact O-N 3.27Å
18	D	33.9	Very low	35.3	Very low	146 Å²	146	128.4 Å²	128.4	78%	0.781	74%	0.74	S	S	*	*			trans	-81.6	94.2	167.8	-71.9	-33	0	0	0	108.4	A20	D18-A20 PolarHBondContact O-N 3.28Å
19	F	31.2	Very low	35.6	Very low	186 Å²	186	128.8 Å²	128.8	82%	0.816	75%	0.748	S	S	*	*			trans	-89.4	83.2	167.3	-163.9	-101.9	0	0	0	108.4	A17 V21	A17-F19 PolarHBondContact O-N 3.27Å; F19-V21 HydrophobicContact CD1-CG2 3.64Å; F19-V21 HydrophobicContact CE1-CG2 3.32Å; F19-V21 HydrophobicContact CZ-CG2 4.32Å; F19-V21 PolarHBondContact O-N 3.14Å
20	A	35	Very low	36	Very low	86 Å²	86	131.3 Å²	131.3	71%	0.711	75%	0.748	S	S	*	*			trans	-79.9	100	170.3	0	0	0	0	0	109.3	D18 S22	D18-A20 PolarHBondContact O-N 3.28Å; A20-S22 PolarHBondContact O-N 3.31Å
21	V	32.1	Very low	36.8	Very low	120 Å²	120	128.7 Å²	128.7	73%	0.727	75%	0.745	S	S	*	*			trans	-73.2	84	157.9	-178.6	0	0	0	0	106.6	F19	F19-V21 HydrophobicContact CD1-CG2 3.64Å; F19-V21 HydrophobicContact CE1-CG2 3.32Å; F19-V21 HydrophobicContact CZ-CG2 4.32Å; F19-V21 PolarHBondContact O-N 3.14Å
22	S	31	Very low	37.2	Very low	83 Å²	83	126.5 Å²	126.5	58%	0.58	74%	0.741	S	S	*	*			trans	-92.7	104.2	169.9	-163	0	0	0	0	108.3	A20 T24	A20-S22 PolarHBondContact O-N 3.31Å; S22-T24 PolarHBondContact O-N 2.95Å
23	C	29.7	Very low	37.7	Very low	117 Å²	117	125.9 Å²	125.9	79%	0.791	74%	0.743	S	S	*	*			trans	-75	75.7	165.7	-162.6	0	0	0	0	107.5	I25	C23-I25 PolarHBondContact O-N 3.34Å; C23-I25 VanDerWaalsContact O-N 3.07Å
24	T	33.3	Very low	38	Very low	98 Å²	98	123.4 Å²	123.4	60%	0.601	74%	0.743	S	S	*	*			trans	-76.8	91.8	177.8	21.3	0	0	0	0	110.3	S22 T26	S22-T24 PolarHBondContact O-N 2.95Å; T24-T26 HydrophobicContact CG2-CG2 4.4Å; T24-T26 PolarHBondContact O-N 3.44Å
25	I	39.2	Very low	38.3	Very low	149 Å²	149	122.5 Å²	122.5	76%	0.764	74%	0.742	S	S	*	*			trans	-68.4	88	152.7	-57.6	174.6	0	0	0	105.6	C23 S27	C23-I25 PolarHBondContact O-N 3.34Å; C23-I25 VanDerWaalsContact O-N 3.07Å; I25-S27 PolarHBondContact O-N 2.88Å; I25-S27 VanDerWaalsContact O-N 3.15Å
26	T	37	Very low	38.4	Very low	120 Å²	120	126.8 Å²	126.8	74%	0.736	75%	0.753	S	S	*	*			trans	-78.7	93.8	173.4	32.8	0	0	0	0	108.4	T24	T24-T26 HydrophobicContact CG2-CG2 4.4Å; T24-T26 PolarHBondContact O-N 3.44Å
27	S	40.6	Very low	39.1	Very low	98 Å²	98	128 Å²	128	69%	0.685	76%	0.759	S	S	*	*			trans	-62.1	126.7	161.7	-64.8	0	0	0	0	108.8	I25 V29	I25-S27 PolarHBondContact O-N 2.88Å; I25-S27 VanDerWaalsContact O-N 3.15Å; S27-V29 PolarHBondContact O-N 3.46Å
28	P	50.8	Low	39.6	Very low	107 Å²	107	127.7 Å²	127.7	70%	0.695	76%	0.756	S	S	*	*			trans	-72.8	121.6	174.5	29.8	-31	0	0	0	108.7	L30	P28-L30 PolarHBondContact O-N 3.2Å
29	V	42.3	Very low	40.3	Very low	150 Å²	150	130.5 Å²	130.5	91%	0.909	76%	0.761	S	S	*	*			trans	-64.1	101.2	167.4	178.2	0	0	0	0	107.3	S27	S27-V29 PolarHBondContact O-N 3.46Å
30	L	45.7	Very low	41	Very low	145 Å²	145	130.4 Å²	130.4	76%	0.759	76%	0.763	S	S	*	*			trans	-88.8	136.3	170.4	-93.7	135.3	0	0	0	109.7	P28	P28-L30 PolarHBondContact O-N 3.2Å
31	P	49.2	Very low	41.8	Very low	102 Å²	102	129.5 Å²	129.5	66%	0.662	76%	0.762	S	S	*	*			trans	-68.1	149.8	173.7	31.1	-33.7	0	0	0	109.8	T33	P31-T33 PolarHBondContact O-N 3.36Å
32	P	42.3	Very low	42.7	Very low	121 Å²	121	129.5 Å²	129.5	79%	0.786	77%	0.768	S	S	*	*	S	Bend	trans	-79.8	109.1	-179.6	31.9	-27.8	0	0	0	107.4
33	T	44.1	Very low	44.4	Very low	130 Å²	130	131.1 Å²	131.1	80%	0.798	78%	0.779	S	S	*	*			trans	172.3	139.9	144.4	30.9	0	0	0	0	110.5	P31	P31-T33 PolarHBondContact O-N 3.36Å
34	L	41.8	Very low	46.4	Very low	158 Å²	158	130.6 Å²	130.6	83%	0.827	78%	0.783	S	S	*	*	S	Bend	trans	84.9	107	173.4	-83.4	88.4	0	0	0	120
35	S	41.3	Very low	48.3	Very low	104 Å²	104	134.3 Å²	134.3	73%	0.727	79%	0.791	S	S	*	*			trans	70.9	101.5	142	59.2	0	0	0	0	119.6	F37	S35-F37 PolarHBondContact O-N 2.95Å
36	L	36.9	Very low	50.3	Low	170 Å²	170	135.3 Å²	135.3	89%	0.89	79%	0.785	S	S	*	*			trans	-48.3	107.2	155.8	-111.5	76.5	0	0	0	111.6
37	F	47.4	Very low	52.3	Low	202 Å²	202	135 Å²	135	89%	0.886	79%	0.787	S	S	*	*			trans	-149.4	74.4	147.5	-97.8	-77.2	0	0	0	107.6	S35 K39	S35-F37 PolarHBondContact O-N 2.95Å; F37-K39 PolarHBondContact O-N 3.42Å
38	A	46.8	Very low	54.6	Low	90 Å²	90	131.5 Å²	131.5	74%	0.744	76%	0.763	S	S	*	*			trans	-71	97.2	170.4	0	0	0	0	0	108.8	Q40	A38-Q40 PolarHBondContact O-N 3.24Å
39	K	48.9	Very low	56.6	Low	205 Å²	205	134 Å²	134	89%	0.891	77%	0.765	S	S	*	*			trans	-69.4	104.3	160	-90.6	-178.9	174.3	179.2	0	107.4	F37 G41	F37-K39 PolarHBondContact O-N 3.42Å; K39-G41 PolarHBondContact O-N 3.09Å
40	Q	46.7	Very low	59	Low	184 Å²	184	130.7 Å²	130.7	86%	0.86	75%	0.746	S	S	*	*			trans	-65.1	83.9	168.3	-141.6	112.6	-1.2	0	0	108.7	A38	A38-Q40 PolarHBondContact O-N 3.24Å
41	G	50.9	Low	61.1	Low	66 Å²	66	127.2 Å²	127.2	68%	0.68	73%	0.728	S	S	*	*			trans	-90.4	99.1	171.3	0	0	0	0	0	109.4	K39 S43	K39-G41 PolarHBondContact O-N 3.09Å; G41-S43 PolarHBondContact O-N 2.93Å
42	S	51.9	Low	62.9	Low	121 Å²	121	128.7 Å²	128.7	85%	0.846	73%	0.729	S	S	*	*			trans	-66	98.6	168.5	-58.5	0	0	0	0	109.3	A44	S42-A44 PolarHBondContact O-N 3.41Å
43	S	66.8	Low	65.2	Low	117 Å²	117	128.6 Å²	128.6	82%	0.818	73%	0.726	S	S	*	*			trans	-79.2	107	166.5	38.7	0	0	0	0	108.9	G41 F45	G41-S43 PolarHBondContact O-N 2.93Å; S43-F45 PolarHBondContact O-N 3.36Å
44	A	71.4	Confident	67.4	Low	106 Å²	106	131.6 Å²	131.6	88%	0.876	73%	0.729	S	S	*	*			trans	-68.8	111	167.2	0	0	0	0	0	108.5	S42	S42-A44 PolarHBondContact O-N 3.41Å
45	F	72.9	Confident	69.8	Low	175 Å²	175	128.1 Å²	128.1	77%	0.768	72%	0.716	S	S	*	*			trans	-79.3	124.4	171.8	-174.1	-96.4	0	0	0	108.8	S43 C47	S43-F45 PolarHBondContact O-N 3.36Å; F45-C47 VanDerWaalsContact CD1-SG 3.52Å
46	R	80.3	Confident	72.3	Confident	170 Å²	170	129 Å²	129	64%	0.642	71%	0.712	S	S	*	*			trans	-78.3	121.9	173.3	-172.3	-177.8	-179.7	-169.1	-5.6	107.7	A48 D51	R46-A48 HydrophobicContact CG-CB 3.91Å; R46-D51 WeakPolarHBondContact CG-OD2 3.48Å
47	C	80	Confident	75	Confident	115 Å²	115	126.9 Å²	126.9	78%	0.777	69%	0.693	S	S	*	*			trans	-101.5	56.5	171.1	-63.4	0	0	0	0	109.6	F45	F45-C47 VanDerWaalsContact CD1-SG 3.52Å
48	A	88.7	Confident	77.1	Confident	23 Å²	23	119.8 Å²	119.8	19%	0.19	67%	0.669	C	S	.	*			trans	-86.9	147.8	173.8	0	0	0	0	0	109.6	R46 T50 D51	R46-A48 HydrophobicContact CG-CB 3.91Å; A48-T50 VanDerWaalsContact CB-OG1 3.28Å; A48-T50 WeakPolarHBondContact CB-OG1 3.35Å; A48-T50 PolarHBondContact O-N 3.3Å; A48-D51 WeakPolarHBondContact CB-OD2 3.48Å; A48-D51 PolarHBondContact N-OD2 2.94Å; A48-D51 WeakPolarHBondContact O-CB 3.42Å; A48-D51 PolarHBondContact O-N 2.67Å
49	H	92.4	Very high	79.4	Confident	159 Å²	159	125.8 Å²	125.8	74%	0.736	67%	0.672	S	S	*	*	G	3₁₀ helix	trans	-57.4	-19.7	172.6	69.7	-83.7	0	0	0	112.5	D51 I52	H49-D51 VanDerWaalsContact C-N 3.25Å; H49-D51 PolarHBondContact O-N 2.77Å; H49-I52 PolarHBondContact O-N 2.81Å
50	T	91.8	Very high	81.5	Confident	81 Å²	81	124.3 Å²	124.3	50%	0.497	66%	0.662	S	S	.	*	G	3₁₀ helix	trans	-71	-16.4	174.8	55.7	0	0	0	0	113.9	A48 I52	A48-T50 VanDerWaalsContact CB-OG1 3.28Å; A48-T50 WeakPolarHBondContact CB-OG1 3.35Å; A48-T50 PolarHBondContact O-N 3.3Å; T50-I52 VanDerWaalsContact C-N 3.34Å
51	D	90	Very high	83.8	Confident	72 Å²	72	120.6 Å²	120.6	39%	0.385	64%	0.64	S	S	.	*	G	3₁₀ helix	trans	-88.9	-7.1	-178.8	-52.4	-38.6	0	0	0	111.7	R46 A48 H49 T53	R46-D51 WeakPolarHBondContact CG-OD2 3.48Å; A48-D51 WeakPolarHBondContact CB-OD2 3.48Å; A48-D51 PolarHBondContact N-OD2 2.94Å; A48-D51 WeakPolarHBondContact O-CB 3.42Å; A48-D51 PolarHBondContact O-N 2.67Å; H49-D51 VanDerWaalsContact C-N 3.25Å; H49-D51 PolarHBondContact O-N 2.77Å; D51-T53 PolarHBondContact O-N 3.09Å
52	I	87.9	Confident	85.7	Confident	133 Å²	133	122.7 Å²	122.7	68%	0.682	63%	0.628	S	S	*	*			trans	-80.9	111.3	175.5	-57.4	174.4	0	0	0	108.7	H49 T50	H49-I52 PolarHBondContact O-N 2.81Å; T50-I52 VanDerWaalsContact C-N 3.34Å
53	T	90	Very high	87.6	Confident	119 Å²	119	123 Å²	123	73%	0.73	62%	0.62	S	S	*	*	P	Polyproline II helix	trans	-99.9	143.6	169.4	57.6	0	0	0	0	110.2	D51	D51-T53 PolarHBondContact O-N 3.09Å
54	F	90.5	Very high	88.7	Confident	194 Å²	194	120.2 Å²	120.2	85%	0.851	60%	0.6	S	S	*	*	P	Polyproline II helix	trans	-68.8	133.7	173.9	-65.5	-76.5	0	0	0	109.6
55	P	93.1	Very high	89.7	Confident	85 Å²	85	116 Å²	116	55%	0.552	56%	0.564	S	S	*	*	P	Polyproline II helix	trans	-56.5	149.3	172.6	-24.4	33.8	0	0	0	111.5	Y57	P55-Y57 HydrophobicContact CB-CE2 4.16Å; P55-Y57 WeakPolarHBondContact O-CD2 3.35Å; P55-Y57 WeakPolarHBondContact O-CE2 3.44Å; P55-Y57 PolarHBondContact O-N 3.4Å
56	D	92.6	Very high	90.6	Very high	122 Å²	122	112.3 Å²	112.3	65%	0.652	55%	0.547	S	S	*	.	P	Polyproline II helix	trans	-73	121.5	172.7	-178.7	24.1	0	0	0	110.8	S58	D56-S58 VanDerWaalsContact CG-OG 3.29Å; D56-S58 VanDerWaalsContact OD1-CB 3.25Å; D56-S58 WeakPolarHBondContact OD1-CB 3.45Å; D56-S58 PolarHBondContact OD1-N 3.49Å; D56-S58 PolarHBondContact OD1-OG 3.13Å; D56-S58 WeakPolarHBondContact OD2-CB 3.18Å; D56-S58 PolarHBondContact OD2-OG 2.96Å
57	Y	94.6	Very high	91.1	Very high	126 Å²	126	108.7 Å²	108.7	49%	0.494	54%	0.541	S	S	.	.			trans	-102.3	11.3	176.9	-70.1	-84.4	0	0	0	112.9	P55 R59 Y60 R61	P55-Y57 HydrophobicContact CB-CE2 4.16Å; P55-Y57 WeakPolarHBondContact O-CD2 3.35Å; P55-Y57 WeakPolarHBondContact O-CE2 3.44Å; P55-Y57 PolarHBondContact O-N 3.4Å; Y57-R59 PolarHBondContact O-N 3.25Å; Y57-R59 VanDerWaalsContact O-N 3.08Å; Y57-Y60 AromaticContact CD1-CD2 3.96Å; Y57-Y60 HydrophobicContact CD1-CD2 3.96Å; Y57-Y60 PolarHBondContact O-N 2.83Å; Y57-R61 WeakPolarHBondContact O-CG 3.29Å; Y57-R61 PolarHBondContact O-N 3.45Å
58	S	92	Very high	91.4	Very high	53 Å²	53	109.1 Å²	109.1	37%	0.371	54%	0.539	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.3	-36.3	-179.3	63	0	0	0	0	113.6	D56 Y60 K66	D56-S58 VanDerWaalsContact CG-OG 3.29Å; D56-S58 VanDerWaalsContact OD1-CB 3.25Å; D56-S58 WeakPolarHBondContact OD1-CB 3.45Å; D56-S58 PolarHBondContact OD1-N 3.49Å; D56-S58 PolarHBondContact OD1-OG 3.13Å; D56-S58 WeakPolarHBondContact OD2-CB 3.18Å; D56-S58 PolarHBondContact OD2-OG 2.96Å; S58-Y60 VanDerWaalsContact C-N 3.3Å; S58-Y60 PolarHBondContact O-N 3.19Å; S58-K66 WeakPolarHBondContact O-CE 3.2Å
59	R	93.9	Very high	91.5	Very high	215 Å²	215	115.4 Å²	115.4	81%	0.811	57%	0.57	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63	-30.8	175.4	-173	177.6	-178.9	-178	0.8	113.9	Y57	Y57-R59 PolarHBondContact O-N 3.25Å; Y57-R59 VanDerWaalsContact O-N 3.08Å
60	Y	93.9	Very high	91.4	Very high	175 Å²	175	110.1 Å²	110.1	69%	0.686	55%	0.553	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.6	-17	-175.5	-58.1	-79	0	0	0	113.3	Y57 S58	Y57-Y60 AromaticContact CD1-CD2 3.96Å; Y57-Y60 HydrophobicContact CD1-CD2 3.96Å; Y57-Y60 PolarHBondContact O-N 2.83Å; S58-Y60 VanDerWaalsContact C-N 3.3Å; S58-Y60 PolarHBondContact O-N 3.19Å
61	R	93.6	Very high	91.3	Very high	105 Å²	105	113.9 Å²	113.9	40%	0.396	56%	0.559	S	S	.	*	S	Bend	trans	-66.9	140.4	179.2	-75	179.6	-177.4	-152.4	5.7	110.9	Y57 T65 K66	Y57-R61 WeakPolarHBondContact O-CG 3.29Å; Y57-R61 PolarHBondContact O-N 3.45Å; R61-T65 PolarHBondContact NH1-O 3.11Å; R61-K66 HydrophobicContact CB-CG 4.11Å; R61-K66 VanDerWaalsContact O-CE 3.29Å; R61-K66 WeakPolarHBondContact O-CE 3.47Å
62	R	91.8	Very high	91.4	Very high	111 Å²	111	114.4 Å²	114.4	42%	0.419	56%	0.561	S	S	.	*			trans	-60.9	146.1	167.3	-64	-175.9	-176.4	178.5	3.3	108.7	S64 T65 R79 S83	R62-S64 PolarHBondContact O-N 3.42Å; R62-T65 PolarHBondContact O-N 3.49Å; R62-T65 PolarHBondContact O-OG1 3.08Å; R62-R79 PolarHBondContact NH1-O 3.34Å; R62-S83 PolarHBondContact NH2-OG 3.21Å; R62-S83 VanDerWaalsContact NH2-OG 3.12Å
63	D	91.8	Very high	91.5	Very high	128 Å²	128	113.6 Å²	113.6	68%	0.684	56%	0.555	S	S	*	*	G	3₁₀ helix	trans	-53.6	-35	-175.9	-64.4	-42.6	0	0	0	113.1	T65 K66	D63-T65 PolarHBondContact O-N 2.87Å; D63-T65 VanDerWaalsContact O-N 3.12Å; D63-K66 PolarHBondContact O-N 3.45Å; D63-K66 VanDerWaalsContact OD1-CE 3.26Å; D63-K66 WeakPolarHBondContact OD1-CE 3.43Å; D63-K66 IonicContact OD1-NZ 2.67Å; D63-K66 PolarHBondContact OD1-NZ 3.29Å
64	S	90.7	Very high	91.6	Very high	57 Å²	57	113.5 Å²	113.5	40%	0.399	55%	0.55	S	S	.	.	G	3₁₀ helix	trans	-65.7	-9.5	176.2	56.2	0	0	0	0	115.8	R62 R79	R62-S64 PolarHBondContact O-N 3.42Å; S64-R79 WeakPolarHBondContact OG-CD 3.17Å
65	T	91.7	Very high	91.5	Very high	19 Å²	19	105.9 Å²	105.9	12%	0.117	52%	0.519	C	S	.	.	G	3₁₀ helix	trans	-123.2	8.2	-177.7	58	0	0	0	0	113.3	R61 R62 D63	R61-T65 PolarHBondContact NH1-O 3.11Å; R62-T65 PolarHBondContact O-N 3.49Å; R62-T65 PolarHBondContact O-OG1 3.08Å; D63-T65 PolarHBondContact O-N 2.87Å; D63-T65 VanDerWaalsContact O-N 3.12Å
66	K	91.7	Very high	91.5	Very high	97 Å²	97	105 Å²	105	42%	0.422	51%	0.508	S	S	.	.			trans	-76.2	-30.9	179.1	-74.2	-177.7	178.6	168.8	0	112.7	S58 R61 D63 V68	S58-K66 WeakPolarHBondContact O-CE 3.2Å; R61-K66 HydrophobicContact CB-CG 4.11Å; R61-K66 VanDerWaalsContact O-CE 3.29Å; R61-K66 WeakPolarHBondContact O-CE 3.47Å; D63-K66 PolarHBondContact O-N 3.45Å; D63-K66 VanDerWaalsContact OD1-CE 3.26Å; D63-K66 WeakPolarHBondContact OD1-CE 3.43Å; D63-K66 IonicContact OD1-NZ 2.67Å; D63-K66 PolarHBondContact OD1-NZ 3.29Å; K66-V68 PolarHBondContact O-N 2.98Å
67	N	90	Very high	91.6	Very high	94 Å²	94	104.3 Å²	104.3	50%	0.503	51%	0.508	S	S	.	.			trans	-75.4	112.1	177.3	-174.4	-4.4	0	0	0	110.6	N69 A70	N67-N69 PolarHBondContact O-N 3.11Å; N67-N69 PolarHBondContact OD1-N 3.01Å; N67-A70 HydrophobicContact CB-CB 4.08Å; N67-A70 PolarHBondContact O-N 2.79Å
68	V	87.7	Confident	91.5	Very high	123 Å²	123	102 Å²	102	75%	0.745	51%	0.508	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.5	-23.6	-178.9	-175.8	0	0	0	0	112.4	K66	K66-V68 PolarHBondContact O-N 2.98Å
69	N	89.6	Confident	91.6	Very high	155 Å²	155	102.3 Å²	102.3	83%	0.829	50%	0.501	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.3	-7.5	-177	-60.2	-33.6	0	0	0	113.4	N67	N67-N69 PolarHBondContact O-N 3.11Å; N67-N69 PolarHBondContact OD1-N 3.01Å
70	A	90.5	Very high	91.7	Very high	48 Å²	48	96.4 Å²	96.4	40%	0.397	48%	0.482	S	S	.	.	S	Bend	trans	-92.2	146.8	177.6	0	0	0	0	0	111	N67 N72	N67-A70 HydrophobicContact CB-CB 4.08Å; N67-A70 PolarHBondContact O-N 2.79Å; A70-N72 PolarHBondContact O-N 3.48Å
71	R	90.8	Very high	91.7	Very high	161 Å²	161	93.1 Å²	93.1	61%	0.608	48%	0.475	S	S	*	.			trans	-70.6	126.5	175.6	-67.2	177.5	67.9	173.3	-0.8	109.9	E73 D74	R71-E73 IonicContact CZ-OE2 2.7Å; R71-E73 IonicContact NE-OE2 2.67Å; R71-E73 IonicContact NH2-OE2 3.7Å; R71-E73 PolarHBondContact NH2-OE2 2.81Å; R71-E73 PolarHBondContact O-N 3.04Å; R71-D74 PolarHBondContact O-N 3.03Å
72	N	90.4	Very high	91.7	Very high	82 Å²	82	94.6 Å²	94.6	44%	0.439	49%	0.485	S	S	.	.	S	Bend	trans	-67.9	-23.5	178.1	-80	-33	0	0	0	113.7	A70 T75 E76 R79	A70-N72 PolarHBondContact O-N 3.48Å; N72-T75 PolarHBondContact O-N 2.95Å; N72-T75 PolarHBondContact O-OG1 3.01Å; N72-E76 PolarHBondContact O-N 3.49Å; N72-R79 PolarHBondContact O-NH2 3.28Å
73	E	91.8	Very high	91.8	Very high	116 Å²	116	91.7 Å²	91.7	54%	0.542	48%	0.482	S	S	.	.	S	Bend	trans	-64.4	-38.8	179.2	-67.9	172.4	174.9	0	0	111.6	R71 T75 E76	R71-E73 IonicContact CZ-OE2 2.7Å; R71-E73 IonicContact NE-OE2 2.67Å; R71-E73 IonicContact NH2-OE2 3.7Å; R71-E73 PolarHBondContact NH2-OE2 2.81Å; R71-E73 PolarHBondContact O-N 3.04Å; E73-T75 PolarHBondContact O-N 3.21Å; E73-T75 VanDerWaalsContact O-N 3.11Å; E73-E76 WeakPolarHBondContact O-CB 3.23Å; E73-E76 PolarHBondContact O-N 3.43Å
74	D	90.8	Very high	92.1	Very high	117 Å²	117	92.8 Å²	92.8	63%	0.626	48%	0.477	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-25.6	-177.7	-60.7	-17.7	0	0	0	112.4	R71	R71-D74 PolarHBondContact O-N 3.03Å
75	T	89.8	Confident	92.4	Very high	35 Å²	35	95 Å²	95	22%	0.215	48%	0.484	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.9	6.9	178.6	69.8	0	0	0	0	113.2	N72 E73 P78 R79	N72-T75 PolarHBondContact O-N 2.95Å; N72-T75 PolarHBondContact O-OG1 3.01Å; E73-T75 PolarHBondContact O-N 3.21Å; E73-T75 VanDerWaalsContact O-N 3.11Å; T75-P78 WeakPolarHBondContact O-CD 3.26Å; T75-P78 WeakPolarHBondContact O-CG 3.29Å; T75-R79 WeakPolarHBondContact O-CB 3.24Å; T75-R79 VanDerWaalsContact O-CG 3.23Å; T75-R79 WeakPolarHBondContact O-CG 3.49Å; T75-R79 PolarHBondContact O-N 3.44Å; T75-R79 PolarHBondContact O-NE 2.85Å; T75-R79 PolarHBondContact OG1-NE 2.99Å
76	E	92.7	Very high	92.6	Very high	66 Å²	66	97.1 Å²	97.1	31%	0.308	50%	0.5	S	S	.	.	H	α-helix	trans	-67.3	-50.4	-175	-174	-172.4	158.3	0	0	113	N72 E73 R79 K80	N72-E76 PolarHBondContact O-N 3.49Å; E73-E76 WeakPolarHBondContact O-CB 3.23Å; E73-E76 PolarHBondContact O-N 3.43Å; E76-R79 VanDerWaalsContact CA-NH2 3.29Å; E76-R79 PolarHBondContact O-N 3.11Å; E76-K80 HydrophobicContact CG-CD 3.98Å; E76-K80 HydrophobicContact CG-CG 4.38Å; E76-K80 PolarHBondContact O-N 3.46Å; E76-K80 WeakPolarHBondContact OE1-CE 3.32Å; E76-K80 IonicContact OE1-NZ 3.61Å; E76-K80 PolarHBondContact OE1-NZ 3.05Å
77	V	93.7	Very high	92.8	Very high	107 Å²	107	97.8 Å²	97.8	65%	0.648	51%	0.507	S	S	*	.	H	α-helix	trans	-55.8	-54.2	-178.2	178.4	0	0	0	0	112	R79 K80 L81	V77-R79 VanDerWaalsContact C-N 3.29Å; V77-R79 PolarHBondContact O-N 2.92Å; V77-K80 PolarHBondContact O-N 3Å; V77-L81 WeakPolarHBondContact O-CB 3.11Å; V77-L81 PolarHBondContact O-N 2.78Å
78	P	93.5	Very high	93.2	Very high	79 Å²	79	94.9 Å²	94.9	51%	0.513	50%	0.5	S	S	.	.	H	α-helix	trans	-63.5	-33.2	179.6	23	-33.3	0	0	0	113	T75 F82	T75-P78 WeakPolarHBondContact O-CD 3.26Å; T75-P78 WeakPolarHBondContact O-CG 3.29Å; P78-F82 PolarHBondContact O-N 3.19Å; P78-F82 VanDerWaalsContact O-N 3.08Å
79	R	93.5	Very high	93.6	Very high	58 Å²	58	92.6 Å²	92.6	22%	0.219	49%	0.486	C	S	.	.	H	α-helix	trans	-66.3	-44.2	176.5	-76.3	-176.4	-64.3	109.8	-7.3	112.2	R62 S64 N72 T75 E76 V77	R62-R79 PolarHBondContact NH1-O 3.34Å; S64-R79 WeakPolarHBondContact OG-CD 3.17Å; N72-R79 PolarHBondContact O-NH2 3.28Å; T75-R79 WeakPolarHBondContact O-CB 3.24Å; T75-R79 VanDerWaalsContact O-CG 3.23Å; T75-R79 WeakPolarHBondContact O-CG 3.49Å; T75-R79 PolarHBondContact O-N 3.44Å; T75-R79 PolarHBondContact O-NE 2.85Å; T75-R79 PolarHBondContact OG1-NE 2.99Å; E76-R79 VanDerWaalsContact CA-NH2 3.29Å; E76-R79 PolarHBondContact O-N 3.11Å; V77-R79 VanDerWaalsContact C-N 3.29Å; V77-R79 PolarHBondContact O-N 2.92Å
80	K	95	Very high	94	Very high	92 Å²	92	86.8 Å²	86.8	40%	0.4	46%	0.463	S	S	.	.	H	α-helix	trans	-70.7	-42.6	177.1	-76.8	-175.5	173.5	179.4	0	111.2	E76 V77 F82 S83 Y84	E76-K80 HydrophobicContact CG-CD 3.98Å; E76-K80 HydrophobicContact CG-CG 4.38Å; E76-K80 PolarHBondContact O-N 3.46Å; E76-K80 WeakPolarHBondContact OE1-CE 3.32Å; E76-K80 IonicContact OE1-NZ 3.61Å; E76-K80 PolarHBondContact OE1-NZ 3.05Å; V77-K80 PolarHBondContact O-N 3Å; K80-F82 PolarHBondContact O-N 2.99Å; K80-S83 PolarHBondContact O-N 3.34Å; K80-S83 VanDerWaalsContact O-N 3.15Å; K80-Y84 HydrophobicContact CB-CD2 4.03Å; K80-Y84 HydrophobicContact CB-CE2 3.82Å; K80-Y84 HydrophobicContact CD-CE2 4.29Å; K80-Y84 HydrophobicContact CG-CE2 4.29Å; K80-Y84 VanDerWaalsContact O-CD2 3.26Å; K80-Y84 WeakPolarHBondContact O-CD2 3.46Å; K80-Y84 PolarHBondContact O-N 3.48Å
81	L	95.7	Very high	94.3	Very high	106 Å²	106	88.3 Å²	88.3	56%	0.555	47%	0.467	S	S	*	.	H	α-helix	trans	-57.7	-46.2	178.6	179.8	61.7	0	0	0	111.4	V77 S83 Y84 L85	V77-L81 WeakPolarHBondContact O-CB 3.11Å; V77-L81 PolarHBondContact O-N 2.78Å; L81-S83 VanDerWaalsContact C-N 3.34Å; L81-S83 PolarHBondContact O-N 3.02Å; L81-Y84 PolarHBondContact O-N 3.17Å; L81-L85 WeakPolarHBondContact O-CB 3.42Å; L81-L85 PolarHBondContact O-N 2.67Å
82	F	93.2	Very high	94.7	Very high	135 Å²	135	83.1 Å²	83.1	59%	0.592	46%	0.458	S	S	*	.	H	α-helix	trans	-55	-50.2	175.1	176.5	-101	0	0	0	111.5	P78 K80 L85 S86	P78-F82 PolarHBondContact O-N 3.19Å; P78-F82 VanDerWaalsContact O-N 3.08Å; K80-F82 PolarHBondContact O-N 2.99Å; F82-L85 PolarHBondContact O-N 2.04Å; F82-S86 WeakPolarHBondContact O-CB 3.43Å; F82-S86 PolarHBondContact O-N 3.22Å; F82-S86 PolarHBondContact O-OG 3.45Å
83	S	94.4	Very high	95	Very high	51 Å²	51	84.3 Å²	84.3	36%	0.357	46%	0.464	S	S	.	.	H	α-helix	trans	-65.9	-42.7	-179	-67.2	0	0	0	0	113.2	R62 K80 L81 L87	R62-S83 PolarHBondContact NH2-OG 3.21Å; R62-S83 VanDerWaalsContact NH2-OG 3.12Å; K80-S83 PolarHBondContact O-N 3.34Å; K80-S83 VanDerWaalsContact O-N 3.15Å; L81-S83 VanDerWaalsContact C-N 3.34Å; L81-S83 PolarHBondContact O-N 3.02Å; S83-L87 PolarHBondContact O-N 3.42Å; S83-L87 VanDerWaalsContact O-N 3.14Å
84	Y	97.4	Very high	95.3	Very high	151 Å²	151	83.1 Å²	83.1	59%	0.592	47%	0.465	S	S	*	.	H	α-helix	trans	-72	-35.2	178.2	-66.9	-43.9	0	0	0	112.8	K80 L81 L87 G88	K80-Y84 HydrophobicContact CB-CD2 4.03Å; K80-Y84 HydrophobicContact CB-CE2 3.82Å; K80-Y84 HydrophobicContact CD-CE2 4.29Å; K80-Y84 HydrophobicContact CG-CE2 4.29Å; K80-Y84 VanDerWaalsContact O-CD2 3.26Å; K80-Y84 WeakPolarHBondContact O-CD2 3.46Å; K80-Y84 PolarHBondContact O-N 3.48Å; L81-Y84 PolarHBondContact O-N 3.17Å; Y84-L87 PolarHBondContact O-N 2.92Å; Y84-G88 PolarHBondContact O-N 2.86Å
85	L	97	Very high	95.6	Very high	104 Å²	104	80.5 Å²	80.5	55%	0.545	46%	0.459	S	S	.	.	H	α-helix	trans	-66.6	-46.3	175.6	-179.6	62.9	0	0	0	110.8	L81 F82 L87 G88 V89	L81-L85 WeakPolarHBondContact O-CB 3.42Å; L81-L85 PolarHBondContact O-N 2.67Å; F82-L85 PolarHBondContact O-N 2.04Å; L85-L87 VanDerWaalsContact C-N 3.3Å; L85-L87 PolarHBondContact O-N 3.09Å; L85-G88 PolarHBondContact O-N 3.36Å; L85-V89 HydrophobicContact CD1-CG2 4.08Å; L85-V89 HydrophobicContact CG-CG2 4.42Å; L85-V89 WeakPolarHBondContact O-CG2 3.33Å; L85-V89 PolarHBondContact O-N 2.58Å
86	S	95.1	Very high	96	Very high	63 Å²	63	84.1 Å²	84.1	44%	0.441	48%	0.477	S	S	.	.	H	α-helix	trans	-59.2	-41.7	175.9	-59.8	0	0	0	0	111.9	F82 G90	F82-S86 WeakPolarHBondContact O-CB 3.43Å; F82-S86 PolarHBondContact O-N 3.22Å; F82-S86 PolarHBondContact O-OG 3.45Å; S86-G90 PolarHBondContact O-N 2.76Å
87	L	97.1	Very high	96.2	Very high	110 Å²	110	83.7 Å²	83.7	58%	0.576	48%	0.481	S	S	*	.	H	α-helix	trans	-64.5	-47.5	174.2	-178.9	62.7	0	0	0	111.5	S83 Y84 L85 V89 G90 T91	S83-L87 PolarHBondContact O-N 3.42Å; S83-L87 VanDerWaalsContact O-N 3.14Å; Y84-L87 PolarHBondContact O-N 2.92Å; L85-L87 VanDerWaalsContact C-N 3.3Å; L85-L87 PolarHBondContact O-N 3.09Å; L87-V89 PolarHBondContact O-N 2.73Å; L87-G90 PolarHBondContact O-N 3.21Å; L87-T91 HydrophobicContact CD1-CG2 4.1Å; L87-T91 HydrophobicContact CG-CG2 4.41Å; L87-T91 VanDerWaalsContact O-CG2 3.3Å; L87-T91 WeakPolarHBondContact O-CG2 2.99Å; L87-T91 PolarHBondContact O-N 3.19Å; L87-T91 PolarHBondContact O-OG1 2.71Å
88	G	97.1	Very high	96.4	Very high	34 Å²	34	80.8 Å²	80.8	35%	0.351	47%	0.468	S	S	.	.	H	α-helix	trans	-58.5	-48.5	179.3	0	0	0	0	0	112.6	Y84 L85 T91 A92	Y84-G88 PolarHBondContact O-N 2.86Å; L85-G88 PolarHBondContact O-N 3.36Å; G88-T91 PolarHBondContact O-N 3.36Å; G88-T91 PolarHBondContact O-OG1 3.48Å; G88-A92 WeakPolarHBondContact O-CB 3.35Å; G88-A92 PolarHBondContact O-N 2.89Å
89	V	97.5	Very high	96.6	Very high	75 Å²	75	83.3 Å²	83.3	46%	0.455	47%	0.471	S	S	.	.	H	α-helix	trans	-62.7	-44.8	176.6	173.6	0	0	0	0	111.1	L85 L87 T91 A92 I93	L85-V89 HydrophobicContact CD1-CG2 4.08Å; L85-V89 HydrophobicContact CG-CG2 4.42Å; L85-V89 WeakPolarHBondContact O-CG2 3.33Å; L85-V89 PolarHBondContact O-N 2.58Å; L87-V89 PolarHBondContact O-N 2.73Å; V89-T91 PolarHBondContact O-N 3.41Å; V89-A92 PolarHBondContact O-N 3.44Å; V89-I93 HydrophobicContact CG1-CD1 3.84Å; V89-I93 HydrophobicContact CG1-CG1 4.49Å; V89-I93 WeakPolarHBondContact O-CG1 3.31Å; V89-I93 PolarHBondContact O-N 3.25Å
90	G	97.2	Very high	96.8	Very high	33 Å²	33	84.4 Å²	84.4	34%	0.34	48%	0.484	S	S	.	.	H	α-helix	trans	-58.2	-49.1	177	0	0	0	0	0	112.1	S86 L87 A92 I93 T94	S86-G90 PolarHBondContact O-N 2.76Å; L87-G90 PolarHBondContact O-N 3.21Å; G90-A92 VanDerWaalsContact C-N 3.34Å; G90-A92 PolarHBondContact O-N 3.01Å; G90-I93 PolarHBondContact O-N 2.88Å; G90-T94 PolarHBondContact O-N 3.05Å; G90-T94 PolarHBondContact O-OG1 3.32Å; G90-T94 VanDerWaalsContact O-OG1 3.08Å
91	T	97.6	Very high	96.8	Very high	80 Å²	80	84.3 Å²	84.3	49%	0.491	49%	0.487	S	S	.	.	H	α-helix	trans	-62.5	-38.8	177.9	59.1	0	0	0	0	112.7	L87 G88 V89 T94 A95	L87-T91 HydrophobicContact CD1-CG2 4.1Å; L87-T91 HydrophobicContact CG-CG2 4.41Å; L87-T91 VanDerWaalsContact O-CG2 3.3Å; L87-T91 WeakPolarHBondContact O-CG2 2.99Å; L87-T91 PolarHBondContact O-N 3.19Å; L87-T91 PolarHBondContact O-OG1 2.71Å; G88-T91 PolarHBondContact O-N 3.36Å; G88-T91 PolarHBondContact O-OG1 3.48Å; V89-T91 PolarHBondContact O-N 3.41Å; T91-T94 PolarHBondContact O-N 2.81Å; T91-A95 WeakPolarHBondContact O-CB 3.35Å; T91-A95 PolarHBondContact O-N 2.92Å
92	A	97.4	Very high	96.9	Very high	51 Å²	51	82.9 Å²	82.9	42%	0.421	48%	0.483	S	S	.	.	H	α-helix	trans	-64.7	-44.2	177.7	0	0	0	0	0	112.1	G88 V89 G90 A95 L96	G88-A92 WeakPolarHBondContact O-CB 3.35Å; G88-A92 PolarHBondContact O-N 2.89Å; V89-A92 PolarHBondContact O-N 3.44Å; G90-A92 VanDerWaalsContact C-N 3.34Å; G90-A92 PolarHBondContact O-N 3.01Å; A92-A95 PolarHBondContact O-N 3.44Å; A92-L96 WeakPolarHBondContact O-CG 3.45Å; A92-L96 PolarHBondContact O-N 3.39Å
93	I	97.5	Very high	97	Very high	107 Å²	107	81 Å²	81	55%	0.549	48%	0.479	S	S	.	.	H	α-helix	trans	-62.6	-46.1	176.8	-67.3	168.6	0	0	0	110.4	V89 G90 A95 L96 S97	V89-I93 HydrophobicContact CG1-CD1 3.84Å; V89-I93 HydrophobicContact CG1-CG1 4.49Å; V89-I93 WeakPolarHBondContact O-CG1 3.31Å; V89-I93 PolarHBondContact O-N 3.25Å; G90-I93 PolarHBondContact O-N 2.88Å; I93-A95 VanDerWaalsContact C-N 3.34Å; I93-A95 PolarHBondContact O-N 2.83Å; I93-L96 PolarHBondContact O-N 2.94Å; I93-S97 PolarHBondContact O-N 2.71Å; I93-S97 PolarHBondContact O-OG 3.43Å
94	T	97.4	Very high	97	Very high	92 Å²	92	84.4 Å²	84.4	56%	0.564	49%	0.489	S	S	*	.	H	α-helix	trans	-62.5	-39.4	177.3	-57	0	0	0	0	112.2	G90 T91 S97 A98	G90-T94 PolarHBondContact O-N 3.05Å; G90-T94 PolarHBondContact O-OG1 3.32Å; G90-T94 VanDerWaalsContact O-OG1 3.08Å; T91-T94 PolarHBondContact O-N 2.81Å; T94-S97 WeakPolarHBondContact CA-OG 3.35Å; T94-S97 PolarHBondContact O-N 3.11Å; T94-S97 PolarHBondContact O-OG 3.43Å; T94-A98 VanDerWaalsContact O-CB 3.26Å; T94-A98 WeakPolarHBondContact O-CB 3.43Å; T94-A98 PolarHBondContact O-N 3.29Å
95	A	97.5	Very high	96.8	Very high	62 Å²	62	84.3 Å²	84.3	51%	0.512	49%	0.492	S	S	.	.	H	α-helix	trans	-65.5	-41.8	177	0	0	0	0	0	111.9	T91 A92 I93 K99	T91-A95 WeakPolarHBondContact O-CB 3.35Å; T91-A95 PolarHBondContact O-N 2.92Å; A92-A95 PolarHBondContact O-N 3.44Å; I93-A95 VanDerWaalsContact C-N 3.34Å; I93-A95 PolarHBondContact O-N 2.83Å; A95-K99 WeakPolarHBondContact O-CB 3.3Å; A95-K99 PolarHBondContact O-N 2.86Å
96	L	97.6	Very high	96.6	Very high	111 Å²	111	84.4 Å²	84.4	58%	0.581	49%	0.492	S	S	*	.	H	α-helix	trans	-66	-43.1	176.6	-71.3	172.8	0	0	0	112	A92 I93 K99 V100	A92-L96 WeakPolarHBondContact O-CG 3.45Å; A92-L96 PolarHBondContact O-N 3.39Å; I93-L96 PolarHBondContact O-N 2.94Å; L96-K99 WeakPolarHBondContact O-CB 3.23Å; L96-K99 PolarHBondContact O-N 2.94Å; L96-V100 WeakPolarHBondContact O-CG2 3.31Å; L96-V100 PolarHBondContact O-N 2.83Å
97	S	97.4	Very high	96.4	Very high	56 Å²	56	83.9 Å²	83.9	39%	0.392	50%	0.496	S	S	.	.	H	α-helix	trans	-65.2	-43	177.6	66.4	0	0	0	0	111.6	I93 T94 K99 V100 L101	I93-S97 PolarHBondContact O-N 2.71Å; I93-S97 PolarHBondContact O-OG 3.43Å; T94-S97 WeakPolarHBondContact CA-OG 3.35Å; T94-S97 PolarHBondContact O-N 3.11Å; T94-S97 PolarHBondContact O-OG 3.43Å; S97-K99 VanDerWaalsContact C-N 3.32Å; S97-K99 PolarHBondContact O-N 2.93Å; S97-V100 PolarHBondContact O-N 3.21Å; S97-L101 WeakPolarHBondContact O-CG 3.36Å; S97-L101 PolarHBondContact O-N 3.4Å
98	A	97.5	Very high	95.9	Very high	47 Å²	47	88.2 Å²	88.2	39%	0.388	51%	0.507	S	S	.	.	H	α-helix	trans	-59.3	-42.5	174.3	0	0	0	0	0	111.7	T94 T102	T94-A98 VanDerWaalsContact O-CB 3.26Å; T94-A98 WeakPolarHBondContact O-CB 3.43Å; T94-A98 PolarHBondContact O-N 3.29Å; A98-T102 VanDerWaalsContact O-CB 3.24Å; A98-T102 WeakPolarHBondContact O-CB 3.43Å; A98-T102 PolarHBondContact O-N 3.43Å; A98-T102 PolarHBondContact O-OG1 3.43Å
99	K	97.7	Very high	95.5	Very high	132 Å²	132	95.5 Å²	95.5	57%	0.574	53%	0.528	S	S	*	.	H	α-helix	trans	-59.5	-51.3	175.4	177.3	-175	176.1	-177.7	0	111.4	A95 L96 S97 T102 L103	A95-K99 WeakPolarHBondContact O-CB 3.3Å; A95-K99 PolarHBondContact O-N 2.86Å; L96-K99 WeakPolarHBondContact O-CB 3.23Å; L96-K99 PolarHBondContact O-N 2.94Å; S97-K99 VanDerWaalsContact C-N 3.32Å; S97-K99 PolarHBondContact O-N 2.93Å; K99-T102 PolarHBondContact O-N 3.36Å; K99-L103 HydrophobicContact CG-CD1 3.94Å; K99-L103 HydrophobicContact CG-CG 4.48Å; K99-L103 WeakPolarHBondContact O-CB 3.32Å; K99-L103 VanDerWaalsContact O-CG 3.28Å; K99-L103 WeakPolarHBondContact O-CG 2.99Å; K99-L103 PolarHBondContact O-N 2.82Å
100	V	97.3	Very high	94.9	Very high	80 Å²	80	93.9 Å²	93.9	49%	0.485	53%	0.527	S	S	.	.	H	α-helix	trans	-62.6	-47.5	-177.2	172.4	0	0	0	0	111.1	L96 S97 T102 L103 Q104	L96-V100 WeakPolarHBondContact O-CG2 3.31Å; L96-V100 PolarHBondContact O-N 2.83Å; S97-V100 PolarHBondContact O-N 3.21Å; V100-T102 PolarHBondContact O-N 3.48Å; V100-L103 PolarHBondContact O-N 2.81Å; V100-Q104 WeakPolarHBondContact O-CG 3.24Å; V100-Q104 PolarHBondContact O-N 2.98Å
101	L	96.8	Very high	94.1	Very high	91 Å²	91	95 Å²	95	48%	0.476	53%	0.534	S	S	.	.	H	α-helix	trans	-62.4	-45.4	178.8	-69.8	173.1	0	0	0	111.6	S97 L103 Q104 F105	S97-L101 WeakPolarHBondContact O-CG 3.36Å; S97-L101 PolarHBondContact O-N 3.4Å; L101-L103 VanDerWaalsContact C-N 3.33Å; L101-L103 PolarHBondContact O-N 3.06Å; L101-Q104 WeakPolarHBondContact O-CB 3.09Å; L101-Q104 PolarHBondContact O-N 3.18Å; L101-Q104 VanDerWaalsContact O-N 3.15Å; L101-F105 WeakPolarHBondContact O-CD2 3.28Å; L101-F105 PolarHBondContact O-N 3.03Å
102	T	96.3	Very high	93.1	Very high	75 Å²	75	94.2 Å²	94.2	46%	0.46	53%	0.529	S	S	.	.	H	α-helix	trans	-60.9	-43.4	178.3	-56.9	0	0	0	0	111.2	A98 K99 V100 Q104 F105 I106	A98-T102 VanDerWaalsContact O-CB 3.24Å; A98-T102 WeakPolarHBondContact O-CB 3.43Å; A98-T102 PolarHBondContact O-N 3.43Å; A98-T102 PolarHBondContact O-OG1 3.43Å; K99-T102 PolarHBondContact O-N 3.36Å; V100-T102 PolarHBondContact O-N 3.48Å; T102-Q104 VanDerWaalsContact C-N 3.32Å; T102-Q104 PolarHBondContact O-N 2.86Å; T102-F105 PolarHBondContact O-N 2.99Å; T102-I106 HydrophobicContact CG2-CD1 3.77Å; T102-I106 HydrophobicContact CG2-CG1 4.36Å; T102-I106 VanDerWaalsContact O-CG1 3.27Å; T102-I106 WeakPolarHBondContact O-CG1 3.12Å; T102-I106 PolarHBondContact O-N 3Å
103	L	96.1	Very high	91.9	Very high	97 Å²	97	99.2 Å²	99.2	51%	0.508	54%	0.542	S	S	.	.	H	α-helix	trans	-65	-33.7	176.5	-71.4	175.2	0	0	0	112.7	K99 V100 L101 G107	K99-L103 HydrophobicContact CG-CD1 3.94Å; K99-L103 HydrophobicContact CG-CG 4.48Å; K99-L103 WeakPolarHBondContact O-CB 3.32Å; K99-L103 VanDerWaalsContact O-CG 3.28Å; K99-L103 WeakPolarHBondContact O-CG 2.99Å; K99-L103 PolarHBondContact O-N 2.82Å; V100-L103 PolarHBondContact O-N 2.81Å; L101-L103 VanDerWaalsContact C-N 3.33Å; L101-L103 PolarHBondContact O-N 3.06Å; L103-G107 PolarHBondContact O-N 3.39Å
104	Q	94	Very high	90.3	Very high	121 Å²	121	100.6 Å²	100.6	57%	0.565	55%	0.549	S	S	*	.	H	α-helix	trans	-65.8	-43.9	173.3	-73.9	177.7	-24.7	0	0	111.8	V100 L101 T102 G107 Y108	V100-Q104 WeakPolarHBondContact O-CG 3.24Å; V100-Q104 PolarHBondContact O-N 2.98Å; L101-Q104 WeakPolarHBondContact O-CB 3.09Å; L101-Q104 PolarHBondContact O-N 3.18Å; L101-Q104 VanDerWaalsContact O-N 3.15Å; T102-Q104 VanDerWaalsContact C-N 3.32Å; T102-Q104 PolarHBondContact O-N 2.86Å; Q104-G107 PolarHBondContact O-N 2.78Å; Q104-Y108 WeakPolarHBondContact O-CB 3.31Å; Q104-Y108 PolarHBondContact O-N 2.94Å
105	F	93.4	Very high	88.9	Confident	150 Å²	150	101.4 Å²	101.4	66%	0.658	55%	0.546	S	S	*	.	H	α-helix	trans	-67.4	-36.7	176.3	-75	-68.6	0	0	0	113	L101 T102 K109	L101-F105 WeakPolarHBondContact O-CD2 3.28Å; L101-F105 PolarHBondContact O-N 3.03Å; T102-F105 PolarHBondContact O-N 2.99Å; F105-K109 PolarHBondContact O-N 3.04Å
106	I	93.3	Very high	87.4	Confident	105 Å²	105	104.2 Å²	104.2	54%	0.538	55%	0.549	S	S	.	.	H	α-helix	trans	-67.1	-45	173.1	-67.3	169.1	0	0	0	110.1	T102 Y108 K109 G110	T102-I106 HydrophobicContact CG2-CD1 3.77Å; T102-I106 HydrophobicContact CG2-CG1 4.36Å; T102-I106 VanDerWaalsContact O-CG1 3.27Å; T102-I106 WeakPolarHBondContact O-CG1 3.12Å; T102-I106 PolarHBondContact O-N 3Å; I106-Y108 VanDerWaalsContact C-N 3.31Å; I106-Y108 PolarHBondContact O-N 2.85Å; I106-K109 WeakPolarHBondContact O-CB 3.45Å; I106-K109 PolarHBondContact O-N 2.8Å; I106-G110 PolarHBondContact O-N 2.8Å
107	G	89.8	Confident	85.7	Confident	52 Å²	52	102.1 Å²	102.1	54%	0.536	55%	0.548	S	S	.	.	H	α-helix	trans	-62	-37.2	179	0	0	0	0	0	112.7	L103 Q104 K109 G110	L103-G107 PolarHBondContact O-N 3.39Å; Q104-G107 PolarHBondContact O-N 2.78Å; G107-K109 VanDerWaalsContact C-N 3.26Å; G107-K109 PolarHBondContact O-N 3.41Å; G107-G110 PolarHBondContact O-N 2.89Å
108	Y	87.5	Confident	84.4	Confident	202 Å²	202	100.8 Å²	100.8	79%	0.792	54%	0.543	S	S	*	.	H	α-helix	trans	-61.4	-32.6	172.8	175.7	-101.9	0	0	0	113	Q104 I106 G110	Q104-Y108 WeakPolarHBondContact O-CB 3.31Å; Q104-Y108 PolarHBondContact O-N 2.94Å; I106-Y108 VanDerWaalsContact C-N 3.31Å; I106-Y108 PolarHBondContact O-N 2.85Å; Y108-G110 VanDerWaalsContact C-N 3.27Å
109	K	88.2	Confident	83.3	Confident	186 Å²	186	100.1 Å²	100.1	81%	0.809	54%	0.538	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.9	-3.9	173.6	-68.6	-170.7	174.1	-167.3	0	113.7	F105 I106 G107	F105-K109 PolarHBondContact O-N 3.04Å; I106-K109 WeakPolarHBondContact O-CB 3.45Å; I106-K109 PolarHBondContact O-N 2.8Å; G107-K109 VanDerWaalsContact C-N 3.26Å; G107-K109 PolarHBondContact O-N 3.41Å
110	G	86.3	Confident	82.6	Confident	42 Å²	42	96.5 Å²	96.5	43%	0.433	53%	0.526	S	S	.	.	S	Bend	trans	-71	176.5	175.6	0	0	0	0	0	112.9	I106 G107 Y108	I106-G110 PolarHBondContact O-N 2.8Å; G107-G110 PolarHBondContact O-N 2.89Å; Y108-G110 VanDerWaalsContact C-N 3.27Å
111	A	78.9	Confident	82.2	Confident	57 Å²	57	94.7 Å²	94.7	47%	0.471	52%	0.515	S	S	.	.			trans	-62.7	134.1	178.2	0	0	0	0	0	111.1
112	P	77.9	Confident	81.9	Confident	62 Å²	62	95.9 Å²	95.9	40%	0.403	52%	0.518	S	S	.	.			trans	-66.6	149.3	177.6	30.3	-36.2	0	0	0	110.5	I114 E115	P112-I114 HydrophobicContact CB-CG1 4.07Å; P112-I114 HydrophobicContact CG-CG1 4Å; P112-I114 PolarHBondContact O-N 3.15Å; P112-E115 HydrophobicContact CG-CG 3.96Å; P112-E115 PolarHBondContact O-N 2.91Å
113	F	71.4	Confident	81.7	Confident	156 Å²	156	92.5 Å²	92.5	68%	0.684	50%	0.498	S	S	*	.	H	α-helix	trans	-53.4	-30.3	-178.2	179	-103.9	0	0	0	113.5	E115 Q116 A117	F113-E115 VanDerWaalsContact C-N 3.28Å; F113-E115 PolarHBondContact O-N 2.9Å; F113-Q116 WeakPolarHBondContact O-CB 3.48Å; F113-Q116 PolarHBondContact O-N 3.38Å; F113-Q116 VanDerWaalsContact O-N 3.1Å; F113-A117 HydrophobicContact CE1-CB 4.33Å; F113-A117 WeakPolarHBondContact O-CB 3.42Å; F113-A117 PolarHBondContact O-N 2.84Å
114	I	64	Low	81.5	Confident	137 Å²	137	91.1 Å²	91.1	70%	0.703	49%	0.49	S	S	*	.	H	α-helix	trans	-63.5	-30	177.9	60.7	170.2	0	0	0	113.5	P112 G118	P112-I114 HydrophobicContact CB-CG1 4.07Å; P112-I114 HydrophobicContact CG-CG1 4Å; P112-I114 PolarHBondContact O-N 3.15Å; I114-G118 PolarHBondContact O-N 3.25Å
115	E	67.9	Low	81.4	Confident	108 Å²	108	85.5 Å²	85.5	51%	0.505	47%	0.465	S	S	.	.	H	α-helix	trans	-75.1	-31.2	175	-72.5	176	-166.2	0	0	111.4	P112 F113	P112-E115 HydrophobicContact CG-CG 3.96Å; P112-E115 PolarHBondContact O-N 2.91Å; F113-E115 VanDerWaalsContact C-N 3.28Å; F113-E115 PolarHBondContact O-N 2.9Å
116	Q	65.5	Low	81.3	Confident	121 Å²	121	83.1 Å²	83.1	57%	0.565	46%	0.459	S	S	*	.	H	α-helix	trans	-75.7	-36.9	175.6	-63	178.2	-5.1	0	0	111.5	F113 G118 A119	F113-Q116 WeakPolarHBondContact O-CB 3.48Å; F113-Q116 PolarHBondContact O-N 3.38Å; F113-Q116 VanDerWaalsContact O-N 3.1Å; Q116-G118 PolarHBondContact O-N 3.4Å; Q116-A119 WeakPolarHBondContact O-CB 3.48Å; Q116-A119 PolarHBondContact O-N 2.79Å
117	A	63.2	Low	81.2	Confident	67 Å²	67	83.8 Å²	83.8	55%	0.554	46%	0.463	S	S	*	.	H	α-helix	trans	-65.4	-26.3	177.5	0	0	0	0	0	112.8	F113 A119	F113-A117 HydrophobicContact CE1-CB 4.33Å; F113-A117 WeakPolarHBondContact O-CB 3.42Å; F113-A117 PolarHBondContact O-N 2.84Å; A117-A119 PolarHBondContact O-N 2.89Å
118	G	68.8	Low	81.3	Confident	28 Å²	28	81.6 Å²	81.6	29%	0.289	44%	0.439	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.9	31	170.1	0	0	0	0	0	114.1	I114 Q116 V120	I114-G118 PolarHBondContact O-N 3.25Å; Q116-G118 PolarHBondContact O-N 3.4Å; G118-V120 VanDerWaalsContact C-N 3.28Å; G118-V120 PolarHBondContact O-N 3.46Å
119	A	74.7	Confident	81.5	Confident	34 Å²	34	75.1 Å²	75.1	28%	0.281	42%	0.421	S	S	.	.	S	Bend	trans	-59.8	-39.3	-173.8	0	0	0	0	0	112.4	Q116 A117 W138	Q116-A119 WeakPolarHBondContact O-CB 3.48Å; Q116-A119 PolarHBondContact O-N 2.79Å; A117-A119 PolarHBondContact O-N 2.89Å; A119-W138 PolarHBondContact O-NE1 3.35Å; A119-W138 VanDerWaalsContact O-NE1 3.17Å
120	V	83.7	Confident	81.8	Confident	56 Å²	56	71.9 Å²	71.9	34%	0.339	41%	0.409	S	S	.	.			trans	-126.3	131.6	-177.1	-174.6	0	0	0	0	109.7	G118 L241 I242 K244	G118-V120 VanDerWaalsContact C-N 3.28Å; G118-V120 PolarHBondContact O-N 3.46Å; V120-L241 HydrophobicContact CG1-CB 4.14Å; V120-L241 HydrophobicContact CG1-CD2 4.29Å; V120-I242 VanDerWaalsContact CA-O 3.31Å; V120-I242 WeakPolarHBondContact CA-O 3.34Å; V120-K244 VanDerWaalsContact CG2-O 3.3Å; V120-K244 WeakPolarHBondContact CG2-O 3.25Å
121	V	87.6	Confident	82.1	Confident	41 Å²	41	71 Å²	71	25%	0.248	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	127.7	172.5	167.9	0	0	0	0	108.8	I123 W138 I242	V121-I123 HydrophobicContact CG1-CG1 3.9Å; V121-W138 HydrophobicContact CG2-CG 4.48Å; V121-I242 PolarHBondContact N-O 3.04Å; V121-I242 PolarHBondContact O-N 3.18Å
122	E	91	Very high	82.7	Confident	116 Å²	116	74.6 Å²	74.6	54%	0.542	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	125.8	171	-42	-156.2	142.6	0	0	109	K235 T239 L241	E122-K235 IonicContact OE1-NZ 3.95Å; E122-K235 PolarHBondContact OE1-NZ 3.34Å; E122-K235 IonicContact OE2-NZ 3.48Å; E122-T239 HydrophobicContact CB-CG2 4.18Å; E122-L241 HydrophobicContact CB-CD2 3.9Å; E122-L241 HydrophobicContact CG-CD2 3.38Å; E122-L241 WeakPolarHBondContact OE1-CD2 3.43Å
123	I	92	Very high	83.5	Confident	5 Å²	5	72.8 Å²	72.8	3%	0.026	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	125.5	175.8	-58.2	-178.3	0	0	0	108.7	V121 F136 V145 T239 V240 I242	V121-I123 HydrophobicContact CG1-CG1 3.9Å; I123-F136 HydrophobicContact CD1-CB 3.64Å; I123-F136 HydrophobicContact CD1-CD1 4.33Å; I123-F136 HydrophobicContact CD1-CD2 3.66Å; I123-F136 HydrophobicContact CD1-CE2 4.36Å; I123-F136 HydrophobicContact CD1-CG 3.62Å; I123-F136 HydrophobicContact CG1-CB 4.46Å; I123-F136 HydrophobicContact CG1-CD1 4.48Å; I123-F136 HydrophobicContact CG1-CD2 4.49Å; I123-F136 HydrophobicContact CG1-CG 4.24Å; I123-F136 HydrophobicContact CG2-CD1 4.19Å; I123-F136 HydrophobicContact CG2-CD2 3.9Å; I123-F136 HydrophobicContact CG2-CE1 3.87Å; I123-F136 HydrophobicContact CG2-CE2 3.55Å; I123-F136 HydrophobicContact CG2-CG 4.2Å; I123-F136 HydrophobicContact CG2-CZ 3.53Å; I123-V145 HydrophobicContact CD1-CG2 3.85Å; I123-T239 WeakPolarHBondContact O-CA 3.29Å; I123-V240 HydrophobicContact CB-CG1 3.86Å; I123-V240 PolarHBondContact N-O 2.88Å; I123-V240 PolarHBondContact O-N 3.34Å; I123-I242 HydrophobicContact CD1-CD1 3.38Å; I123-I242 HydrophobicContact CD1-CG1 4.5Å; I123-I242 HydrophobicContact CG1-CD1 4.27Å
124	N	92.8	Very high	84.6	Confident	67 Å²	67	66 Å²	66	36%	0.358	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	120.2	170.6	-172.5	-20.3	0	0	0	109.8	D126 L127 R238	N124-D126 VanDerWaalsContact C-N 3.29Å; N124-D126 PolarHBondContact O-N 2.76Å; N124-D126 VanDerWaalsContact OD1-CB 3.25Å; N124-D126 WeakPolarHBondContact OD1-CB 3.29Å; N124-D126 PolarHBondContact OD1-N 3.41Å; N124-D126 PolarHBondContact OD1-OD2 3.08Å; N124-L127 HydrophobicContact CB-CD1 4.24Å; N124-L127 HydrophobicContact CB-CG 4.3Å; N124-L127 WeakPolarHBondContact O-CB 3.21Å; N124-L127 PolarHBondContact O-N 3.13Å; N124-R238 WeakPolarHBondContact CA-O 3.41Å; N124-R238 PolarHBondContact OD1-O 3.07Å
125	L	91.4	Very high	86	Confident	4 Å²	4	63.1 Å²	63.1	2%	0.021	36%	0.355	C	S	.	.	G	3₁₀ helix	trans	-69.6	-24	-178.8	-63.2	175.8	0	0	0	112.6	L127 V128 V145 W179 F234 R238 V240	L125-L127 PolarHBondContact O-N 3.43Å; L125-L127 VanDerWaalsContact O-N 3.13Å; L125-V128 PolarHBondContact O-N 2.9Å; L125-V145 HydrophobicContact CD2-CG1 4.19Å; L125-W179 HydrophobicContact CB-CH2 3.76Å; L125-W179 HydrophobicContact CB-CZ2 3.68Å; L125-W179 HydrophobicContact CB-CZ3 4.49Å; L125-W179 HydrophobicContact CD1-CD2 4.43Å; L125-W179 HydrophobicContact CD1-CZ2 4.07Å; L125-W179 HydrophobicContact CD2-CD2 3.96Å; L125-W179 HydrophobicContact CD2-CE3 3.88Å; L125-W179 HydrophobicContact CD2-CH2 3.97Å; L125-W179 HydrophobicContact CD2-CZ2 4.07Å; L125-W179 HydrophobicContact CD2-CZ3 3.87Å; L125-W179 HydrophobicContact CG-CH2 4.35Å; L125-W179 HydrophobicContact CG-CZ2 4.15Å; L125-F234 HydrophobicContact CD1-CD1 4.18Å; L125-F234 HydrophobicContact CD1-CE1 4.07Å; L125-R238 WeakPolarHBondContact CB-O 3.48Å; L125-R238 WeakPolarHBondContact CG-O 3.4Å; L125-R238 PolarHBondContact N-O 3.06Å; L125-V240 HydrophobicContact CD2-CB 4.2Å; L125-V240 HydrophobicContact CD2-CG1 3.76Å; L125-V240 HydrophobicContact CG-CG1 4.45Å
126	D	91.2	Very high	87.2	Confident	100 Å²	100	60.5 Å²	60.5	54%	0.535	34%	0.342	S	S	.	.	G	3₁₀ helix	trans	-62.5	-21.5	177.2	-62.9	-26.4	0	0	0	112.2	N124 V128 R238	N124-D126 VanDerWaalsContact C-N 3.29Å; N124-D126 PolarHBondContact O-N 2.76Å; N124-D126 VanDerWaalsContact OD1-CB 3.25Å; N124-D126 WeakPolarHBondContact OD1-CB 3.29Å; N124-D126 PolarHBondContact OD1-N 3.41Å; N124-D126 PolarHBondContact OD1-OD2 3.08Å; D126-V128 PolarHBondContact O-N 2.84Å; D126-R238 WeakPolarHBondContact OD2-CD 3.27Å
127	L	91.1	Very high	88.3	Confident	119 Å²	119	60.6 Å²	60.6	62%	0.623	35%	0.346	S	S	*	.	G	3₁₀ helix	trans	-71.6	-16.7	177.7	-62.2	174.9	0	0	0	113	N124 L125 P129 F136	N124-L127 HydrophobicContact CB-CD1 4.24Å; N124-L127 HydrophobicContact CB-CG 4.3Å; N124-L127 WeakPolarHBondContact O-CB 3.21Å; N124-L127 PolarHBondContact O-N 3.13Å; L125-L127 PolarHBondContact O-N 3.43Å; L125-L127 VanDerWaalsContact O-N 3.13Å; L127-P129 WeakPolarHBondContact O-CD 3.37Å; L127-F136 HydrophobicContact CB-CZ 4.44Å; L127-F136 HydrophobicContact CD1-CE1 4.19Å; L127-F136 HydrophobicContact CD1-CZ 4.43Å
128	V	92	Very high	89.6	Confident	5 Å²	5	58.5 Å²	58.5	3%	0.03	32%	0.323	C	S	.	.	S	Bend	trans	-114.7	97.9	-176	-171.9	0	0	0	0	109.8	L125 D126 K132 F136 V145 H147 W179	L125-V128 PolarHBondContact O-N 2.9Å; D126-V128 PolarHBondContact O-N 2.84Å; V128-K132 VanDerWaalsContact CG1-O 3.27Å; V128-K132 WeakPolarHBondContact CG1-O 2.79Å; V128-F136 HydrophobicContact CG2-CE2 3.94Å; V128-F136 HydrophobicContact CG2-CZ 4.08Å; V128-V145 HydrophobicContact CG2-CG1 4.4Å; V128-H147 HydrophobicContact CG1-CB 3.94Å; V128-H147 PolarHBondContact O-ND1 3.35Å; V128-H147 VanDerWaalsContact O-ND1 3.15Å; V128-W179 HydrophobicContact CB-CH2 4.48Å; V128-W179 HydrophobicContact CB-CZ3 4.21Å; V128-W179 HydrophobicContact CG1-CZ3 4.43Å
129	P	93	Very high	90.3	Very high	66 Å²	66	63.4 Å²	63.4	43%	0.429	33%	0.333	S	S	.	.			trans	-68.2	157.6	176.1	29.9	-34.8	0	0	0	110.9	L127 G131 K132	L127-P129 WeakPolarHBondContact O-CD 3.37Å; P129-G131 PolarHBondContact O-N 2.81Å; P129-K132 HydrophobicContact CG-CB 3.97Å; P129-K132 HydrophobicContact CG-CD 3.62Å; P129-K132 HydrophobicContact CG-CG 3.86Å; P129-K132 PolarHBondContact O-N 3.49Å
130	E	93.1	Very high	90.7	Very high	119 Å²	119	64.8 Å²	64.8	56%	0.556	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.6	134.5	179.3	-161.3	-169.8	156.8	0	0	111.3	K132 H147 T149	E130-K132 VanDerWaalsContact C-N 3.27Å; E130-K132 PolarHBondContact O-N 3.03Å; E130-H147 PolarHBondContact N-ND1 2.9Å; E130-T149 HydrophobicContact CG-CG2 4.02Å; E130-T149 WeakPolarHBondContact OE1-CA 3.31Å
131	G	92	Very high	90.9	Very high	23 Å²	23	67.1 Å²	67.1	24%	0.237	36%	0.356	C	S	.	.	T	Hydrogen-bonded Turn	trans	75.3	8.6	-177	0	0	0	0	0	114.7	P129 H147 Y196	P129-G131 PolarHBondContact O-N 2.81Å; G131-H147 WeakPolarHBondContact CA-O 3.11Å; G131-H147 PolarHBondContact N-O 3.1Å; G131-Y196 PolarHBondContact O-OH 3.02Å
132	K	93.4	Very high	91.2	Very high	133 Å²	133	66.5 Å²	66.5	58%	0.578	35%	0.353	S	S	*	.			trans	-111.4	156	169.2	-66.7	-160.9	-170.4	173.9	0	112.1	V128 P129 E130 H147 Y196	V128-K132 VanDerWaalsContact CG1-O 3.27Å; V128-K132 WeakPolarHBondContact CG1-O 2.79Å; P129-K132 HydrophobicContact CG-CB 3.97Å; P129-K132 HydrophobicContact CG-CD 3.62Å; P129-K132 HydrophobicContact CG-CG 3.86Å; P129-K132 PolarHBondContact O-N 3.49Å; E130-K132 VanDerWaalsContact C-N 3.27Å; E130-K132 PolarHBondContact O-N 3.03Å; K132-H147 PolarHBondContact O-N 3.28Å; K132-Y196 VanDerWaalsContact CA-OH 3.29Å; K132-Y196 WeakPolarHBondContact CA-OH 3.44Å; K132-Y196 PolarHBondContact N-OH 2.99Å; K132-Y196 PolarHBondContact O-OH 3.48Å
133	N	93.9	Very high	91.4	Very high	23 Å²	23	61 Å²	61	12%	0.123	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	108.8	178.5	-179	82.1	0	0	0	108.9	F144 R146 P195 Y196 Y203	N133-F144 WeakPolarHBondContact ND2-CD1 3.31Å; N133-R146 HydrophobicContact CB-CG 4.5Å; N133-P195 HydrophobicContact CB-CB 3.92Å; N133-P195 HydrophobicContact CB-CG 4.38Å; N133-Y196 HydrophobicContact CB-CE2 3.64Å; N133-Y196 PolarHBondContact N-OH 3.4Å; N133-Y203 PolarHBondContact OD1-OH 2.9Å; N133-Y203 VanDerWaalsContact OD1-OH 3.11Å
134	G	93.9	Very high	91.5	Very high	14 Å²	14	60.9 Å²	60.9	14%	0.144	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76	140.6	169.9	0	0	0	0	0	110.5	F144 V145	G134-F144 WeakPolarHBondContact O-CA 3.46Å; G134-V145 PolarHBondContact N-O 3.29Å; G134-V145 PolarHBondContact O-N 2.98Å
135	T	94	Very high	91.7	Very high	77 Å²	77	57.7 Å²	57.7	47%	0.472	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	119.9	173.6	-52.4	0	0	0	0	108.5	P142 V143 F144	T135-P142 HydrophobicContact CG2-CB 3.78Å; T135-V143 WeakPolarHBondContact CA-O 3.24Å; T135-F144 HydrophobicContact CG2-CD1 4.01Å; T135-F144 HydrophobicContact CG2-CE1 3.85Å; T135-F144 WeakPolarHBondContact OG1-CD1 3.48Å; T135-F144 WeakPolarHBondContact OG1-CE1 3.35Å
136	F	92.9	Very high	91.9	Very high	52 Å²	52	57.5 Å²	57.5	23%	0.228	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	158.2	-178.2	-60.3	-86.8	0	0	0	110	I123 L127 V128 P142 V143 V145	I123-F136 HydrophobicContact CD1-CB 3.64Å; I123-F136 HydrophobicContact CD1-CD1 4.33Å; I123-F136 HydrophobicContact CD1-CD2 3.66Å; I123-F136 HydrophobicContact CD1-CE2 4.36Å; I123-F136 HydrophobicContact CD1-CG 3.62Å; I123-F136 HydrophobicContact CG1-CB 4.46Å; I123-F136 HydrophobicContact CG1-CD1 4.48Å; I123-F136 HydrophobicContact CG1-CD2 4.49Å; I123-F136 HydrophobicContact CG1-CG 4.24Å; I123-F136 HydrophobicContact CG2-CD1 4.19Å; I123-F136 HydrophobicContact CG2-CD2 3.9Å; I123-F136 HydrophobicContact CG2-CE1 3.87Å; I123-F136 HydrophobicContact CG2-CE2 3.55Å; I123-F136 HydrophobicContact CG2-CG 4.2Å; I123-F136 HydrophobicContact CG2-CZ 3.53Å; L127-F136 HydrophobicContact CB-CZ 4.44Å; L127-F136 HydrophobicContact CD1-CE1 4.19Å; L127-F136 HydrophobicContact CD1-CZ 4.43Å; V128-F136 HydrophobicContact CG2-CE2 3.94Å; V128-F136 HydrophobicContact CG2-CZ 4.08Å; F136-P142 CarbonylContact O-C 3.51Å; F136-P142 WeakPolarHBondContact O-CA 3.34Å; F136-V143 PolarHBondContact N-O 2.86Å; F136-V143 PolarHBondContact O-N 2.95Å; F136-V145 HydrophobicContact CD2-CB 4.19Å; F136-V145 HydrophobicContact CD2-CG2 3.82Å; F136-V145 HydrophobicContact CE2-CB 4.01Å; F136-V145 HydrophobicContact CE2-CG2 4.06Å
137	L	89.8	Confident	92.1	Very high	123 Å²	123	54.8 Å²	54.8	64%	0.644	29%	0.293	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99	124.9	-179.7	-170.7	69.6	0	0	0	110.2
138	W	88.7	Confident	92.3	Very high	23 Å²	23	49.2 Å²	49.2	9%	0.087	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	123.4	173.3	180	63.4	0	0	0	109.9	A119 V121 G140 K141 V143 L183 P230 I242	A119-W138 PolarHBondContact O-NE1 3.35Å; A119-W138 VanDerWaalsContact O-NE1 3.17Å; V121-W138 HydrophobicContact CG2-CG 4.48Å; W138-G140 PolarHBondContact O-N 3.19Å; W138-K141 PolarHBondContact N-O 3.17Å; W138-K141 WeakPolarHBondContact O-CA 3.23Å; W138-K141 WeakPolarHBondContact O-CB 3.44Å; W138-K141 PolarHBondContact O-N 3.01Å; W138-V143 HydrophobicContact CB-CG2 3.51Å; W138-V143 HydrophobicContact CE3-CG2 4.2Å; W138-V143 HydrophobicContact CG-CG2 4.38Å; W138-L183 HydrophobicContact CE3-CD2 3.82Å; W138-L183 HydrophobicContact CZ3-CD2 3.88Å; W138-P230 HydrophobicContact CZ3-CB 4.16Å; W138-I242 HydrophobicContact CD2-CG2 3.92Å; W138-I242 HydrophobicContact CE3-CG2 4.18Å; W138-I242 HydrophobicContact CG-CG2 4.27Å; W138-I242 HydrophobicContact CZ2-CG2 4.38Å; W138-I242 PolarHBondContact NE1-O 3.04Å
139	R	83.5	Confident	92.4	Very high	131 Å²	131	50.7 Å²	50.7	49%	0.494	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.1	38.5	-177.3	-60	177.5	175	174.8	-1.2	113.7	K141	R139-K141 PolarHBondContact O-N 3.03Å; R139-K141 VanDerWaalsContact O-N 3.08Å
140	G	83.8	Confident	92.5	Very high	63 Å²	63	51 Å²	51	65%	0.649	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.4	-5.9	-175.6	0	0	0	0	0	115.1	W138	W138-G140 PolarHBondContact O-N 3.19Å
141	K	87.9	Confident	92.5	Very high	105 Å²	105	53.1 Å²	53.1	46%	0.457	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	137.7	176	-63.1	178.5	-178.9	-179.2	0	109.7	W138 R139 P185	W138-K141 PolarHBondContact N-O 3.17Å; W138-K141 WeakPolarHBondContact O-CA 3.23Å; W138-K141 WeakPolarHBondContact O-CB 3.44Å; W138-K141 PolarHBondContact O-N 3.01Å; R139-K141 PolarHBondContact O-N 3.03Å; R139-K141 VanDerWaalsContact O-N 3.08Å; K141-P185 HydrophobicContact CB-CG 4.16Å; K141-P185 HydrophobicContact CD-CG 4.31Å; K141-P185 HydrophobicContact CG-CG 4.24Å
142	P	93.5	Very high	92.6	Very high	29 Å²	29	53.2 Å²	53.2	19%	0.188	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	140.3	171	14.2	-9	0	0	0	110.2	T135 F136 A184 V192	T135-P142 HydrophobicContact CG2-CB 3.78Å; F136-P142 CarbonylContact O-C 3.51Å; F136-P142 WeakPolarHBondContact O-CA 3.34Å; P142-A184 HydrophobicContact CB-CB 3.74Å; P142-A184 HydrophobicContact CG-CB 3.79Å; P142-A184 WeakPolarHBondContact O-CB 3.41Å; P142-A184 PolarHBondContact O-N 3.49Å; P142-V192 HydrophobicContact CG-CG1 4.34Å; P142-V192 HydrophobicContact CG-CG2 3.58Å
143	V	94.8	Very high	92.6	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	128	174.2	-171.1	0	0	0	0	108.1	T135 F136 W138 I181 L182 L183 P230 I242	T135-V143 WeakPolarHBondContact CA-O 3.24Å; F136-V143 PolarHBondContact N-O 2.86Å; F136-V143 PolarHBondContact O-N 2.95Å; W138-V143 HydrophobicContact CB-CG2 3.51Å; W138-V143 HydrophobicContact CE3-CG2 4.2Å; W138-V143 HydrophobicContact CG-CG2 4.38Å; V143-I181 HydrophobicContact CG1-CG2 3.88Å; V143-L182 CarbonylContact C-O 3.51Å; V143-L182 WeakPolarHBondContact CA-O 3.3Å; V143-L182 WeakPolarHBondContact CG1-O 3.42Å; V143-L183 HydrophobicContact CG1-CD2 4.42Å; V143-L183 HydrophobicContact CG2-CD2 3.75Å; V143-P230 HydrophobicContact CG1-CG 4.4Å; V143-I242 HydrophobicContact CG1-CD1 3.96Å
144	F	96	Very high	92.7	Very high	3 Å²	3	53.5 Å²	53.5	1%	0.013	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	128.9	173.8	-65.7	-37	0	0	0	109.8	N133 G134 T135 I181 L182 A184 V192 P193 Y203	N133-F144 WeakPolarHBondContact ND2-CD1 3.31Å; G134-F144 WeakPolarHBondContact O-CA 3.46Å; T135-F144 HydrophobicContact CG2-CD1 4.01Å; T135-F144 HydrophobicContact CG2-CE1 3.85Å; T135-F144 WeakPolarHBondContact OG1-CD1 3.48Å; T135-F144 WeakPolarHBondContact OG1-CE1 3.35Å; F144-I181 VanDerWaalsContact O-CA 3.31Å; F144-I181 WeakPolarHBondContact O-CA 3.47Å; F144-L182 HydrophobicContact CB-CB 4.45Å; F144-L182 PolarHBondContact N-O 3.42Å; F144-L182 PolarHBondContact O-N 3.15Å; F144-A184 HydrophobicContact CD1-CB 4.16Å; F144-A184 HydrophobicContact CD2-CB 3.71Å; F144-A184 HydrophobicContact CE1-CB 3.81Å; F144-A184 HydrophobicContact CE2-CB 3.33Å; F144-A184 HydrophobicContact CG-CB 4.11Å; F144-A184 HydrophobicContact CZ-CB 3.38Å; F144-V192 HydrophobicContact CE1-CG1 4.39Å; F144-V192 HydrophobicContact CZ-CG1 3.81Å; F144-P193 VanDerWaalsContact CZ-O 3.23Å; F144-P193 WeakPolarHBondContact CZ-O 3.47Å; F144-Y203 HydrophobicContact CB-CE1 4.36Å; F144-Y203 AromaticContact CD2-CD1 3.88Å; F144-Y203 HydrophobicContact CD2-CD1 3.88Å; F144-Y203 AromaticContact CD2-CE1 3.46Å; F144-Y203 HydrophobicContact CD2-CE1 3.46Å; F144-Y203 VanDerWaalsContact CD2-CE1 3.46Å; F144-Y203 AromaticContact CE2-CD1 3.76Å; F144-Y203 HydrophobicContact CE2-CD1 3.76Å; F144-Y203 AromaticContact CE2-CE1 3.82Å; F144-Y203 HydrophobicContact CE2-CE1 3.82Å; F144-Y203 AromaticContact CG-CE1 3.94Å; F144-Y203 HydrophobicContact CG-CE1 3.94Å; F144-Y203 HydrophobicContact CZ-CD1 4.49Å
145	V	95.7	Very high	92.6	Very high	0 Å²	0	58 Å²	58	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	105.4	168.3	179.9	0	0	0	0	105.9	I123 L125 V128 G134 F136 W179 I181 I242	I123-V145 HydrophobicContact CD1-CG2 3.85Å; L125-V145 HydrophobicContact CD2-CG1 4.19Å; V128-V145 HydrophobicContact CG2-CG1 4.4Å; G134-V145 PolarHBondContact N-O 3.29Å; G134-V145 PolarHBondContact O-N 2.98Å; F136-V145 HydrophobicContact CD2-CB 4.19Å; F136-V145 HydrophobicContact CD2-CG2 3.82Å; F136-V145 HydrophobicContact CE2-CB 4.01Å; F136-V145 HydrophobicContact CE2-CG2 4.06Å; V145-W179 HydrophobicContact CG1-CE3 4.02Å; V145-W179 HydrophobicContact CG1-CZ3 4.05Å; V145-I181 HydrophobicContact CG1-CG1 4.49Å; V145-I181 HydrophobicContact CG2-CG1 4.43Å; V145-I181 HydrophobicContact CG2-CG2 4.48Å; V145-I242 HydrophobicContact CG2-CD1 4.46Å
146	R	95.2	Very high	92.6	Very high	0 Å²	0	54.5 Å²	54.5	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	125.8	-179.4	-175.3	178.7	-176	147.8	-5.2	109.5	N133 R148 E152 L180 G201 G202	N133-R146 HydrophobicContact CB-CG 4.5Å; R146-R148 HydrophobicContact CG-CG 4.12Å; R146-E152 IonicContact CZ-OE1 3.31Å; R146-E152 IonicContact NE-OE1 3.01Å; R146-E152 IonicContact NE-OE2 3.31Å; R146-E152 IonicContact NH2-OE1 3.11Å; R146-E152 PolarHBondContact NH2-OE1 2.87Å; R146-L180 HydrophobicContact CB-CB 4.31Å; R146-L180 PolarHBondContact N-O 2.59Å; R146-L180 PolarHBondContact O-N 3.45Å; R146-G201 PolarHBondContact NH2-O 3Å; R146-G202 PolarHBondContact NH1-O 3.18Å
147	H	95.5	Very high	92.6	Very high	42 Å²	42	55 Å²	55	19%	0.194	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	105.1	168.9	-166	170.1	0	0	0	107.9	V128 E130 G131 K132 W179	V128-H147 HydrophobicContact CG1-CB 3.94Å; V128-H147 PolarHBondContact O-ND1 3.35Å; V128-H147 VanDerWaalsContact O-ND1 3.15Å; E130-H147 PolarHBondContact N-ND1 2.9Å; G131-H147 WeakPolarHBondContact CA-O 3.11Å; G131-H147 PolarHBondContact N-O 3.1Å; K132-H147 PolarHBondContact O-N 3.28Å; H147-W179 HydrophobicContact CB-CE3 4.14Å; H147-W179 HydrophobicContact CB-CH2 3.82Å; H147-W179 HydrophobicContact CB-CZ3 3.5Å; H147-W179 AromaticContact CE1-CZ2 3.97Å; H147-W179 AromaticContact CG-CH2 3.58Å; H147-W179 AromaticContact CG-CZ3 3.76Å; H147-W179 AromaticContact ND1-CH2 3.46Å; H147-W179 WeakPolarHBondContact ND1-CH2 3.49Å; H147-W179 AromaticContact ND1-CZ2 3.87Å
148	R	95.3	Very high	92.7	Very high	3 Å²	3	55.8 Å²	55.8	1%	0.011	29%	0.291	C	S	.	.			trans	-83	140	-173	-59.7	-168.1	-65.8	178.2	5.4	111.2	R146 E152 I153 D170 P177 E178 L180	R146-R148 HydrophobicContact CG-CG 4.12Å; R148-E152 WeakPolarHBondContact CA-OE2 3.46Å; R148-E152 HydrophobicContact CB-CB 4.43Å; R148-I153 HydrophobicContact CB-CD1 4.39Å; R148-I153 HydrophobicContact CB-CG1 3.92Å; R148-D170 IonicContact CZ-OD1 2.92Å; R148-D170 IonicContact CZ-OD2 2.84Å; R148-D170 VanDerWaalsContact CZ-OD2 3.31Å; R148-D170 IonicContact NH1-OD1 3.25Å; R148-D170 PolarHBondContact NH1-OD1 2.81Å; R148-D170 IonicContact NH1-OD2 2.59Å; R148-D170 PolarHBondContact NH1-OD2 3.34Å; R148-D170 IonicContact NH2-OD1 3.6Å; R148-D170 IonicContact NH2-OD2 3.63Å; R148-D170 PolarHBondContact NH2-OD2 3.28Å; R148-P177 PolarHBondContact NE-O 3.34Å; R148-P177 PolarHBondContact NH2-O 2.84Å; R148-E178 PolarHBondContact N-O 2.93Å; R148-L180 HydrophobicContact CG-CB 4.15Å
149	T	95.4	Very high	92.8	Very high	36 Å²	36	55.8 Å²	55.8	22%	0.221	29%	0.293	C	S	.	.			trans	-76.5	157.6	171.2	63.8	0	0	0	0	111	E130 K151 E152 I153	E130-T149 HydrophobicContact CG-CG2 4.02Å; E130-T149 WeakPolarHBondContact OE1-CA 3.31Å; T149-K151 PolarHBondContact O-N 2.99Å; T149-E152 PolarHBondContact N-OE2 3.1Å; T149-E152 WeakPolarHBondContact O-CB 3.46Å; T149-E152 PolarHBondContact O-N 3.34Å; T149-E152 VanDerWaalsContact OG1-CG 3.3Å; T149-E152 WeakPolarHBondContact OG1-CG 3.13Å; T149-E152 PolarHBondContact OG1-N 3.42Å; T149-E152 PolarHBondContact OG1-OE2 2.99Å; T149-I153 WeakPolarHBondContact O-CG1 3.45Å; T149-I153 PolarHBondContact O-N 3.28Å
150	S	94.2	Very high	93.2	Very high	71 Å²	71	54.1 Å²	54.1	50%	0.497	29%	0.294	S	S	.	.	H	α-helix	trans	-52.6	-40.9	174.8	55.5	0	0	0	0	113	E152 I153 E154	S150-E152 VanDerWaalsContact C-N 3.34Å; S150-E152 PolarHBondContact O-N 3.23Å; S150-I153 PolarHBondContact O-N 3.33Å; S150-E154 WeakPolarHBondContact O-CG 3.43Å; S150-E154 PolarHBondContact O-N 2.95Å
151	K	93.9	Very high	93.4	Very high	165 Å²	165	52.8 Å²	52.8	72%	0.717	27%	0.272	S	S	*	.	H	α-helix	trans	-63.2	-37.1	176.7	-63.6	-173.9	-178.7	-179.3	0	113	T149 R155	T149-K151 PolarHBondContact O-N 2.99Å; K151-R155 WeakPolarHBondContact O-CB 3.48Å; K151-R155 PolarHBondContact O-N 2.7Å; K151-R155 VanDerWaalsContact O-N 3.09Å
152	E	93.4	Very high	93.5	Very high	24 Å²	24	52.4 Å²	52.4	11%	0.112	28%	0.282	C	S	.	.	H	α-helix	trans	-69.2	-42.9	176.4	-72.2	172.6	145.6	0	0	110.9	R146 R148 T149 S150 E154 R155 E156	R146-E152 IonicContact CZ-OE1 3.31Å; R146-E152 IonicContact NE-OE1 3.01Å; R146-E152 IonicContact NE-OE2 3.31Å; R146-E152 IonicContact NH2-OE1 3.11Å; R146-E152 PolarHBondContact NH2-OE1 2.87Å; R148-E152 WeakPolarHBondContact CA-OE2 3.46Å; R148-E152 HydrophobicContact CB-CB 4.43Å; T149-E152 PolarHBondContact N-OE2 3.1Å; T149-E152 WeakPolarHBondContact O-CB 3.46Å; T149-E152 PolarHBondContact O-N 3.34Å; T149-E152 VanDerWaalsContact OG1-CG 3.3Å; T149-E152 WeakPolarHBondContact OG1-CG 3.13Å; T149-E152 PolarHBondContact OG1-N 3.42Å; T149-E152 PolarHBondContact OG1-OE2 2.99Å; S150-E152 VanDerWaalsContact C-N 3.34Å; S150-E152 PolarHBondContact O-N 3.23Å; E152-E154 PolarHBondContact O-N 2.85Å; E152-R155 PolarHBondContact O-N 2.89Å; E152-E156 WeakPolarHBondContact O-CG 3.18Å; E152-E156 PolarHBondContact O-N 3.43Å
153	I	94.4	Very high	93.3	Very high	39 Å²	39	55.8 Å²	55.8	20%	0.2	30%	0.302	C	S	.	.	H	α-helix	trans	-59.5	-48.8	178.1	-62.7	166.1	0	0	0	110.2	R148 T149 S150 R155 E156 A157 P177	R148-I153 HydrophobicContact CB-CD1 4.39Å; R148-I153 HydrophobicContact CB-CG1 3.92Å; T149-I153 WeakPolarHBondContact O-CG1 3.45Å; T149-I153 PolarHBondContact O-N 3.28Å; S150-I153 PolarHBondContact O-N 3.33Å; I153-R155 VanDerWaalsContact C-N 3.34Å; I153-R155 PolarHBondContact O-N 2.8Å; I153-E156 PolarHBondContact O-N 3.28Å; I153-A157 VanDerWaalsContact O-CB 3.26Å; I153-A157 WeakPolarHBondContact O-CB 3.24Å; I153-A157 PolarHBondContact O-N 3.4Å; I153-P177 HydrophobicContact CD1-CB 4.33Å; I153-P177 WeakPolarHBondContact CD1-O 3.31Å; I153-P177 WeakPolarHBondContact CG1-O 3.11Å; I153-P177 HydrophobicContact CG2-CB 4.2Å
154	E	94.1	Very high	93.1	Very high	123 Å²	123	56.4 Å²	56.4	58%	0.575	31%	0.305	S	S	*	.	H	α-helix	trans	-61.5	-40.6	177.3	-72.3	174.9	-171.4	0	0	112.4	S150 E152 N158	S150-E154 WeakPolarHBondContact O-CG 3.43Å; S150-E154 PolarHBondContact O-N 2.95Å; E152-E154 PolarHBondContact O-N 2.85Å; E154-N158 WeakPolarHBondContact O-CB 3.48Å; E154-N158 PolarHBondContact O-N 3.36Å; E154-N158 PolarHBondContact O-ND2 3.04Å
155	R	92.9	Very high	92.9	Very high	109 Å²	109	62.1 Å²	62.1	41%	0.411	33%	0.326	S	S	.	.	H	α-helix	trans	-63.4	-46.7	178.1	-174.4	-174	68.2	-166	-3.5	111.5	K151 E152 I153 N158 V159	K151-R155 WeakPolarHBondContact O-CB 3.48Å; K151-R155 PolarHBondContact O-N 2.7Å; K151-R155 VanDerWaalsContact O-N 3.09Å; E152-R155 PolarHBondContact O-N 2.89Å; I153-R155 VanDerWaalsContact C-N 3.34Å; I153-R155 PolarHBondContact O-N 2.8Å; R155-N158 PolarHBondContact O-N 3.35Å; R155-V159 WeakPolarHBondContact O-CG2 3.36Å
156	E	93.7	Very high	92.7	Very high	4 Å²	4	64 Å²	64	2%	0.019	34%	0.336	C	S	.	.	H	α-helix	trans	-72.9	-29.4	-177.8	-61.4	-49	143	0	0	112.9	E152 I153 D213 G214 R217	E152-E156 WeakPolarHBondContact O-CG 3.18Å; E152-E156 PolarHBondContact O-N 3.43Å; I153-E156 PolarHBondContact O-N 3.28Å; E156-D213 WeakPolarHBondContact OE2-CB 3.12Å; E156-G214 VanDerWaalsContact CD-N 3.28Å; E156-G214 VanDerWaalsContact OE1-CA 3.31Å; E156-G214 WeakPolarHBondContact OE1-CA 3.43Å; E156-G214 PolarHBondContact OE1-N 3.4Å; E156-G214 PolarHBondContact OE2-N 3.44Å; E156-R217 PolarHBondContact O-NH2 3.41Å; E156-R217 IonicContact OE2-NH2 3.27Å; E156-R217 PolarHBondContact OE2-NH2 3.31Å
157	A	92.3	Very high	92.6	Very high	62 Å²	62	67.9 Å²	67.9	51%	0.512	36%	0.362	S	S	.	.	H	α-helix	trans	-68.4	-33.5	174.5	0	0	0	0	0	112.8	I153 V159	I153-A157 VanDerWaalsContact O-CB 3.26Å; I153-A157 WeakPolarHBondContact O-CB 3.24Å; I153-A157 PolarHBondContact O-N 3.4Å; A157-V159 VanDerWaalsContact C-N 3.34Å; A157-V159 PolarHBondContact O-N 2.9Å
158	N	92.1	Very high	92.4	Very high	139 Å²	139	69 Å²	69	74%	0.743	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.6	9.9	-178.5	-70.8	-44.3	0	0	0	114.3	E154 R155	E154-N158 WeakPolarHBondContact O-CB 3.48Å; E154-N158 PolarHBondContact O-N 3.36Å; E154-N158 PolarHBondContact O-ND2 3.04Å; R155-N158 PolarHBondContact O-N 3.35Å
159	V	91.8	Very high	92.3	Very high	23 Å²	23	72.5 Å²	72.5	14%	0.139	38%	0.383	C	S	.	.			trans	-74.6	129.7	178.3	175.5	0	0	0	0	110.6	R155 A157 M161 L164	R155-V159 WeakPolarHBondContact O-CG2 3.36Å; A157-V159 VanDerWaalsContact C-N 3.34Å; A157-V159 PolarHBondContact O-N 2.9Å; V159-M161 PolarHBondContact O-N 3.01Å; V159-L164 HydrophobicContact CG1-CD1 4.45Å; V159-L164 HydrophobicContact CG1-CD2 4.16Å; V159-L164 HydrophobicContact CG1-CG 4.43Å
160	D	90.8	Very high	92.2	Very high	97 Å²	97	71.2 Å²	71.2	52%	0.519	38%	0.375	S	S	.	.			trans	-65.5	122.3	173.3	-176.4	-0.1	0	0	0	111.4	S162 V163	D160-S162 VanDerWaalsContact C-N 3.3Å; D160-S162 PolarHBondContact O-N 3.43Å; D160-S162 WeakPolarHBondContact OD1-CB 3.5Å; D160-S162 PolarHBondContact OD1-N 2.95Å; D160-S162 PolarHBondContact OD1-OG 3.49Å; D160-S162 PolarHBondContact OD2-OG 2.99Å; D160-V163 HydrophobicContact CB-CG2 4.29Å
161	M	88.1	Confident	92.1	Very high	35 Å²	35	74.1 Å²	74.1	17%	0.172	38%	0.381	C	S	.	.	G	3₁₀ helix	trans	-67.5	-28.6	-178.5	-63.1	-51.3	-66.7	0	0	113.5	V159 V163 L164 P167 Q168 H169	V159-M161 PolarHBondContact O-N 3.01Å; M161-V163 PolarHBondContact O-N 3.42Å; M161-L164 HydrophobicContact CE-CD1 4.04Å; M161-L164 PolarHBondContact O-N 2.98Å; M161-L164 HydrophobicContact SD-CD1 3.98Å; M161-P167 HydrophobicContact CE-CB 4.16Å; M161-Q168 VanDerWaalsContact CE-N 3.27Å; M161-Q168 VanDerWaalsContact CE-O 3.29Å; M161-Q168 WeakPolarHBondContact CE-O 3.25Å; M161-H169 HydrophobicContact CE-CB 4.43Å; M161-H169 VanDerWaalsContact CE-N 3.35Å; M161-H169 WeakPolarHBondContact CG-CE1 3.5Å; M161-H169 PolarHBondContact SD-ND1 2.95Å; M161-H169 VanDerWaalsContact SD-ND1 3.42Å
162	S	89.5	Confident	92.1	Very high	97 Å²	97	72 Å²	72	68%	0.678	37%	0.374	S	S	*	.	G	3₁₀ helix	trans	-69.1	-23.4	-175.4	71.7	0	0	0	0	113.1	D160	D160-S162 VanDerWaalsContact C-N 3.3Å; D160-S162 PolarHBondContact O-N 3.43Å; D160-S162 WeakPolarHBondContact OD1-CB 3.5Å; D160-S162 PolarHBondContact OD1-N 2.95Å; D160-S162 PolarHBondContact OD1-OG 3.49Å; D160-S162 PolarHBondContact OD2-OG 2.99Å
163	V	89.8	Confident	92.1	Very high	99 Å²	99	71.5 Å²	71.5	60%	0.6	37%	0.371	S	S	*	.	G	3₁₀ helix	trans	-85	-18.5	-178.6	-175.7	0	0	0	0	111.6	D160 M161	D160-V163 HydrophobicContact CB-CG2 4.29Å; M161-V163 PolarHBondContact O-N 3.42Å
164	L	92.1	Very high	92.1	Very high	13 Å²	13	70.4 Å²	70.4	7%	0.068	37%	0.366	C	S	.	.			trans	-75.6	135.9	-176.8	-62.3	179.8	0	0	0	111.1	V159 M161 D166	V159-L164 HydrophobicContact CG1-CD1 4.45Å; V159-L164 HydrophobicContact CG1-CD2 4.16Å; V159-L164 HydrophobicContact CG1-CG 4.43Å; M161-L164 HydrophobicContact CE-CD1 4.04Å; M161-L164 PolarHBondContact O-N 2.98Å; M161-L164 HydrophobicContact SD-CD1 3.98Å; L164-D166 VanDerWaalsContact C-N 3.3Å
165	R	90.6	Very high	92	Very high	123 Å²	123	70.1 Å²	70.1	46%	0.464	36%	0.364	S	S	.	.	S	Bend	trans	-65.7	-36.4	173.5	-178.8	-178.9	-60.6	144.3	0.3	112.2	I218 G221 A223	R165-I218 HydrophobicContact CB-CG2 4.25Å; R165-I218 VanDerWaalsContact NH1-CG1 3.27Å; R165-G221 VanDerWaalsContact CZ-O 3.27Å; R165-G221 PolarHBondContact NH1-O 3.05Å; R165-G221 PolarHBondContact NH2-O 2.95Å; R165-A223 PolarHBondContact NH1-O 3.3Å
166	D	92.6	Very high	92	Very high	39 Å²	39	67.3 Å²	67.3	21%	0.209	36%	0.355	C	S	.	.	S	Bend	trans	-124.9	89.9	178.7	-178.3	13.7	0	0	0	107.4	L164 Q168 I218 N226	L164-D166 VanDerWaalsContact C-N 3.3Å; D166-Q168 PolarHBondContact O-N 3.41Å; D166-Q168 VanDerWaalsContact O-N 3.08Å; D166-I218 HydrophobicContact CB-CG2 4.4Å; D166-N226 PolarHBondContact O-ND2 3.15Å; D166-N226 VanDerWaalsContact OD2-CG 3.29Å; D166-N226 PolarHBondContact OD2-N 3.39Å; D166-N226 PolarHBondContact OD2-ND2 2.99Å
167	P	91.9	Very high	92	Very high	83 Å²	83	70.2 Å²	70.2	54%	0.539	37%	0.374	S	S	.	.			trans	-71.3	105.4	-170.4	27.7	-33.5	0	0	0	110.5	M161	M161-P167 HydrophobicContact CE-CB 4.16Å
168	Q	92.4	Very high	92	Very high	64 Å²	64	70.3 Å²	70.3	30%	0.299	36%	0.364	S	S	.	.			trans	-135.9	130.6	171	-69.5	-179.5	-10.2	0	0	110.8	M161 D166 R173 R217 N226	M161-Q168 VanDerWaalsContact CE-N 3.27Å; M161-Q168 VanDerWaalsContact CE-O 3.29Å; M161-Q168 WeakPolarHBondContact CE-O 3.25Å; D166-Q168 PolarHBondContact O-N 3.41Å; D166-Q168 VanDerWaalsContact O-N 3.08Å; Q168-R173 HydrophobicContact CB-CG 4.24Å; Q168-R217 VanDerWaalsContact O-CD 3.24Å; Q168-R217 WeakPolarHBondContact O-CD 3.37Å; Q168-R217 PolarHBondContact O-NH1 3.41Å; Q168-N226 PolarHBondContact OE1-ND2 3.32Å
169	H	93	Very high	92.2	Very high	77 Å²	77	64.6 Å²	64.6	36%	0.356	33%	0.332	S	S	.	.			trans	-73	152.2	177.1	-78.6	-78	0	0	0	110.2	M161 H171 E172	M161-H169 HydrophobicContact CE-CB 4.43Å; M161-H169 VanDerWaalsContact CE-N 3.35Å; M161-H169 WeakPolarHBondContact CG-CE1 3.5Å; M161-H169 PolarHBondContact SD-ND1 2.95Å; M161-H169 VanDerWaalsContact SD-ND1 3.42Å; H169-H171 VanDerWaalsContact C-N 3.3Å; H169-H171 WeakPolarHBondContact CB-CE1 2.94Å; H169-H171 WeakPolarHBondContact CB-ND1 2.79Å; H169-H171 AromaticContact CG-CE1 3.56Å; H169-H171 PolarHBondContact O-N 2.97Å; H169-E172 HydrophobicContact CB-CG 4.11Å; H169-E172 PolarHBondContact N-OE2 3.44Å; H169-E172 VanDerWaalsContact N-OE2 3.09Å; H169-E172 PolarHBondContact O-N 3.42Å
170	D	93.4	Very high	92.4	Very high	10 Å²	10	63.5 Å²	63.5	5%	0.053	33%	0.325	C	S	.	.	H	α-helix	trans	-60.9	-40.4	-178.7	-171.8	60.9	0	0	0	112.2	R148 E172 R173 V174 S215	R148-D170 IonicContact CZ-OD1 2.92Å; R148-D170 IonicContact CZ-OD2 2.84Å; R148-D170 VanDerWaalsContact CZ-OD2 3.31Å; R148-D170 IonicContact NH1-OD1 3.25Å; R148-D170 PolarHBondContact NH1-OD1 2.81Å; R148-D170 IonicContact NH1-OD2 2.59Å; R148-D170 PolarHBondContact NH1-OD2 3.34Å; R148-D170 IonicContact NH2-OD1 3.6Å; R148-D170 IonicContact NH2-OD2 3.63Å; R148-D170 PolarHBondContact NH2-OD2 3.28Å; D170-E172 PolarHBondContact O-N 2.89Å; D170-R173 PolarHBondContact O-N 3.03Å; D170-V174 WeakPolarHBondContact O-CG2 3.36Å; D170-V174 PolarHBondContact O-N 3.19Å; D170-S215 WeakPolarHBondContact OD1-CB 3.46Å; D170-S215 PolarHBondContact OD1-OG 3.02Å
171	H	91.9	Very high	92.6	Very high	131 Å²	131	58.9 Å²	58.9	61%	0.606	30%	0.301	S	S	*	.	H	α-helix	trans	-65.9	-19	-179.9	66.4	-98.3	0	0	0	114	H169	H169-H171 VanDerWaalsContact C-N 3.3Å; H169-H171 WeakPolarHBondContact CB-CE1 2.94Å; H169-H171 WeakPolarHBondContact CB-ND1 2.79Å; H169-H171 AromaticContact CG-CE1 3.56Å; H169-H171 PolarHBondContact O-N 2.97Å
172	E	92.5	Very high	93	Very high	122 Å²	122	57.2 Å²	57.2	57%	0.57	29%	0.293	S	S	*	.	H	α-helix	trans	-83.2	-20	176.2	-61.1	172.9	157.8	0	0	111.6	H169 D170	H169-E172 HydrophobicContact CB-CG 4.11Å; H169-E172 PolarHBondContact N-OE2 3.44Å; H169-E172 VanDerWaalsContact N-OE2 3.09Å; H169-E172 PolarHBondContact O-N 3.42Å; D170-E172 PolarHBondContact O-N 2.89Å
173	R	94.1	Very high	93.3	Very high	13 Å²	13	53 Å²	53	5%	0.049	26%	0.262	C	S	.	.	H	α-helix	trans	-94.6	-17.7	-174.9	-64.4	175.5	57.6	70	4.6	112.9	Q168 D170 S215 L227 V229	Q168-R173 HydrophobicContact CB-CG 4.24Å; D170-R173 PolarHBondContact O-N 3.03Å; R173-S215 VanDerWaalsContact CZ-O 3.32Å; R173-S215 PolarHBondContact NE-O 2.99Å; R173-S215 PolarHBondContact NE-OG 3.31Å; R173-S215 PolarHBondContact NH2-O 3.34Å; R173-L227 PolarHBondContact NH1-O 3Å; R173-L227 PolarHBondContact NH2-O 3.15Å; R173-V229 HydrophobicContact CB-CG2 4.15Å; R173-V229 WeakPolarHBondContact O-CG1 3.06Å
174	V	94.9	Very high	93.5	Very high	16 Å²	16	48.2 Å²	48.2	10%	0.097	23%	0.234	C	C	.	.			trans	-126.5	143.1	-176.7	-57.2	0	0	0	0	110.9	D170 L180	D170-V174 WeakPolarHBondContact O-CG2 3.36Å; D170-V174 PolarHBondContact O-N 3.19Å; V174-L180 HydrophobicContact CG1-CB 4.34Å; V174-L180 HydrophobicContact CG1-CD1 3.54Å
175	Q	92.1	Very high	93.7	Very high	117 Å²	117	49.3 Å²	49.3	55%	0.547	24%	0.241	S	C	.	.	S	Bend	trans	-85.1	-40	171.2	-68.2	176.1	36.2	0	0	111.6	Y232 F234	Q175-Y232 HydrophobicContact CB-CE2 4.12Å; Q175-Y232 HydrophobicContact CG-CE2 3.98Å; Q175-Y232 PolarHBondContact N-OH 3.01Å; Q175-Y232 PolarHBondContact NE2-O 3.3Å; Q175-F234 HydrophobicContact CB-CE2 4.05Å
176	K	92.5	Very high	94	Very high	50 Å²	50	43.6 Å²	43.6	22%	0.217	22%	0.22	C	C	.	.	S	Bend	trans	-118	123.5	175.3	-75.1	-174.6	175.7	-170.9	0	108.3	E178 W179 F234 D237	K176-E178 WeakPolarHBondContact CD-OE1 3.47Å; K176-E178 PolarHBondContact O-N 3.08Å; K176-W179 HydrophobicContact CB-CB 4.47Å; K176-W179 PolarHBondContact O-N 3.02Å; K176-F234 HydrophobicContact CB-CE2 4.15Å; K176-F234 HydrophobicContact CB-CZ 4.11Å; K176-F234 HydrophobicContact CD-CD1 4.38Å; K176-F234 HydrophobicContact CD-CD2 4.09Å; K176-F234 HydrophobicContact CD-CE1 4.15Å; K176-F234 HydrophobicContact CD-CE2 3.83Å; K176-F234 HydrophobicContact CD-CG 4.36Å; K176-F234 HydrophobicContact CD-CZ 3.88Å; K176-F234 HydrophobicContact CG-CD2 4.33Å; K176-F234 HydrophobicContact CG-CE2 3.8Å; K176-F234 HydrophobicContact CG-CZ 4.11Å; K176-D237 IonicContact NZ-OD1 2.79Å; K176-D237 PolarHBondContact NZ-OD1 2.97Å
177	P	93.3	Very high	94.1	Very high	65 Å²	65	43.9 Å²	43.9	42%	0.422	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62	-27	-171.6	24.9	-34.4	0	0	0	113.8	R148 I153 W179	R148-P177 PolarHBondContact NE-O 3.34Å; R148-P177 PolarHBondContact NH2-O 2.84Å; I153-P177 HydrophobicContact CD1-CB 4.33Å; I153-P177 WeakPolarHBondContact CD1-O 3.31Å; I153-P177 WeakPolarHBondContact CG1-O 3.11Å; I153-P177 HydrophobicContact CG2-CB 4.2Å; P177-W179 VanDerWaalsContact C-N 3.3Å; P177-W179 PolarHBondContact O-N 3.5Å
178	E	93.9	Very high	94.3	Very high	64 Å²	64	42.7 Å²	42.7	30%	0.299	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-23	175.1	64.9	-85.3	-165.3	0	0	113.5	R148 K176	R148-E178 PolarHBondContact N-O 2.93Å; K176-E178 WeakPolarHBondContact CD-OE1 3.47Å; K176-E178 PolarHBondContact O-N 3.08Å
179	W	95.4	Very high	94.5	Very high	18 Å²	18	45.4 Å²	45.4	7%	0.068	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	116.2	-174.8	-68.4	113.8	0	0	0	111.8	L125 V128 V145 H147 K176 P177 F234	L125-W179 HydrophobicContact CB-CH2 3.76Å; L125-W179 HydrophobicContact CB-CZ2 3.68Å; L125-W179 HydrophobicContact CB-CZ3 4.49Å; L125-W179 HydrophobicContact CD1-CD2 4.43Å; L125-W179 HydrophobicContact CD1-CZ2 4.07Å; L125-W179 HydrophobicContact CD2-CD2 3.96Å; L125-W179 HydrophobicContact CD2-CE3 3.88Å; L125-W179 HydrophobicContact CD2-CH2 3.97Å; L125-W179 HydrophobicContact CD2-CZ2 4.07Å; L125-W179 HydrophobicContact CD2-CZ3 3.87Å; L125-W179 HydrophobicContact CG-CH2 4.35Å; L125-W179 HydrophobicContact CG-CZ2 4.15Å; V128-W179 HydrophobicContact CB-CH2 4.48Å; V128-W179 HydrophobicContact CB-CZ3 4.21Å; V128-W179 HydrophobicContact CG1-CZ3 4.43Å; V145-W179 HydrophobicContact CG1-CE3 4.02Å; V145-W179 HydrophobicContact CG1-CZ3 4.05Å; H147-W179 HydrophobicContact CB-CE3 4.14Å; H147-W179 HydrophobicContact CB-CH2 3.82Å; H147-W179 HydrophobicContact CB-CZ3 3.5Å; H147-W179 AromaticContact CE1-CZ2 3.97Å; H147-W179 AromaticContact CG-CH2 3.58Å; H147-W179 AromaticContact CG-CZ3 3.76Å; H147-W179 AromaticContact ND1-CH2 3.46Å; H147-W179 WeakPolarHBondContact ND1-CH2 3.49Å; H147-W179 AromaticContact ND1-CZ2 3.87Å; K176-W179 HydrophobicContact CB-CB 4.47Å; K176-W179 PolarHBondContact O-N 3.02Å; P177-W179 VanDerWaalsContact C-N 3.3Å; P177-W179 PolarHBondContact O-N 3.5Å; W179-F234 HydrophobicContact CB-CE1 4.4Å; W179-F234 HydrophobicContact CB-CZ 4.02Å; W179-F234 AromaticContact CD1-CE1 3.96Å; W179-F234 HydrophobicContact CG-CE1 4.23Å; W179-F234 HydrophobicContact CG-CZ 4.28Å
180	L	95.4	Very high	94.5	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	119.7	171.2	177.3	70.9	0	0	0	109.7	R146 R148 V174 L182 G214	R146-L180 HydrophobicContact CB-CB 4.31Å; R146-L180 PolarHBondContact N-O 2.59Å; R146-L180 PolarHBondContact O-N 3.45Å; R148-L180 HydrophobicContact CG-CB 4.15Å; V174-L180 HydrophobicContact CG1-CB 4.34Å; V174-L180 HydrophobicContact CG1-CD1 3.54Å; L180-L182 HydrophobicContact CD1-CD1 4.12Å; L180-L182 HydrophobicContact CD1-CD2 4.03Å; L180-L182 HydrophobicContact CD1-CG 3.96Å; L180-L182 HydrophobicContact CD2-CD1 3.69Å; L180-L182 HydrophobicContact CD2-CG 4.31Å; L180-L182 HydrophobicContact CG-CD1 3.83Å; L180-L182 HydrophobicContact CG-CD2 4.49Å; L180-L182 HydrophobicContact CG-CG 3.88Å; L180-G214 WeakPolarHBondContact CD2-O 3.49Å
181	I	95.5	Very high	94.6	Very high	0 Å²	0	45 Å²	45	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	122.5	179.4	-55.7	178.5	0	0	0	108.6	V143 F144 V145 P230 Y232 V240 I242	V143-I181 HydrophobicContact CG1-CG2 3.88Å; F144-I181 VanDerWaalsContact O-CA 3.31Å; F144-I181 WeakPolarHBondContact O-CA 3.47Å; V145-I181 HydrophobicContact CG1-CG1 4.49Å; V145-I181 HydrophobicContact CG2-CG1 4.43Å; V145-I181 HydrophobicContact CG2-CG2 4.48Å; I181-P230 HydrophobicContact CG2-CG 3.74Å; I181-Y232 HydrophobicContact CB-CD1 4.05Å; I181-Y232 HydrophobicContact CB-CE1 4.01Å; I181-Y232 HydrophobicContact CD1-CD1 4.17Å; I181-Y232 HydrophobicContact CD1-CD2 3.8Å; I181-Y232 HydrophobicContact CD1-CE1 4.42Å; I181-Y232 HydrophobicContact CD1-CE2 4.04Å; I181-Y232 HydrophobicContact CD1-CG 3.89Å; I181-Y232 HydrophobicContact CG2-CD1 4.27Å; I181-V240 HydrophobicContact CD1-CB 4.31Å; I181-V240 HydrophobicContact CD1-CG1 4.05Å; I181-V240 HydrophobicContact CD1-CG2 3.57Å; I181-I242 HydrophobicContact CG2-CD1 3.88Å; I181-I242 HydrophobicContact CG2-CG1 4.35Å
182	L	96.2	Very high	94.8	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	142.8	-173.9	-63.3	171.9	0	0	0	111.1	V143 F144 L180 A184 Y203 L227 V229	V143-L182 CarbonylContact C-O 3.51Å; V143-L182 WeakPolarHBondContact CA-O 3.3Å; V143-L182 WeakPolarHBondContact CG1-O 3.42Å; F144-L182 HydrophobicContact CB-CB 4.45Å; F144-L182 PolarHBondContact N-O 3.42Å; F144-L182 PolarHBondContact O-N 3.15Å; L180-L182 HydrophobicContact CD1-CD1 4.12Å; L180-L182 HydrophobicContact CD1-CD2 4.03Å; L180-L182 HydrophobicContact CD1-CG 3.96Å; L180-L182 HydrophobicContact CD2-CD1 3.69Å; L180-L182 HydrophobicContact CD2-CG 4.31Å; L180-L182 HydrophobicContact CG-CD1 3.83Å; L180-L182 HydrophobicContact CG-CD2 4.49Å; L180-L182 HydrophobicContact CG-CG 3.88Å; L182-A184 PolarHBondContact O-N 2.83Å; L182-Y203 HydrophobicContact CD1-CE2 3.88Å; L182-L227 HydrophobicContact CB-CB 4.45Å; L182-L227 HydrophobicContact CD1-CB 4.37Å; L182-L227 HydrophobicContact CD1-CD1 4.18Å; L182-L227 HydrophobicContact CD2-CB 4.29Å; L182-V229 HydrophobicContact CD2-CG2 3.8Å
183	L	95.4	Very high	95	Very high	8 Å²	8	36.5 Å²	36.5	4%	0.042	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	125.9	163.7	-62.8	-173.1	0	0	0	108.9	W138 V143 P185 E228 P230	W138-L183 HydrophobicContact CE3-CD2 3.82Å; W138-L183 HydrophobicContact CZ3-CD2 3.88Å; V143-L183 HydrophobicContact CG1-CD2 4.42Å; V143-L183 HydrophobicContact CG2-CD2 3.75Å; L183-P185 VanDerWaalsContact C-CD 3.45Å; L183-E228 HydrophobicContact CB-CB 4.26Å; L183-E228 HydrophobicContact CD1-CB 4.12Å; L183-E228 HydrophobicContact CD1-CG 3.94Å; L183-E228 HydrophobicContact CG-CB 4.41Å; L183-E228 PolarHBondContact N-O 3.07Å; L183-P230 HydrophobicContact CD2-CB 3.92Å; L183-P230 HydrophobicContact CD2-CG 4.11Å; L183-P230 HydrophobicContact CG-CB 4.13Å; L183-P230 HydrophobicContact CG-CG 4.34Å
184	A	94.7	Very high	95.1	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	22%	0.224	C	C	.	.			trans	-67.8	-34	-177.8	0	0	0	0	0	114.4	P142 F144 L182 C186 V192 P193	P142-A184 HydrophobicContact CB-CB 3.74Å; P142-A184 HydrophobicContact CG-CB 3.79Å; P142-A184 WeakPolarHBondContact O-CB 3.41Å; P142-A184 PolarHBondContact O-N 3.49Å; F144-A184 HydrophobicContact CD1-CB 4.16Å; F144-A184 HydrophobicContact CD2-CB 3.71Å; F144-A184 HydrophobicContact CE1-CB 3.81Å; F144-A184 HydrophobicContact CE2-CB 3.33Å; F144-A184 HydrophobicContact CG-CB 4.11Å; F144-A184 HydrophobicContact CZ-CB 3.38Å; L182-A184 PolarHBondContact O-N 2.83Å; A184-C186 PolarHBondContact O-N 2.83Å; A184-V192 HydrophobicContact CB-CG1 4.2Å; A184-P193 WeakPolarHBondContact O-CD 3.27Å
185	P	95.6	Very high	95.1	Very high	35 Å²	35	40.4 Å²	40.4	23%	0.227	23%	0.231	C	C	.	.	S	Bend	trans	-54	117.8	-178	-29.2	36.7	0	0	0	113.3	K141 L183 T187	K141-P185 HydrophobicContact CB-CG 4.16Å; K141-P185 HydrophobicContact CD-CG 4.31Å; K141-P185 HydrophobicContact CG-CG 4.24Å; L183-P185 VanDerWaalsContact C-CD 3.45Å; P185-T187 PolarHBondContact O-N 3.14Å
186	C	96.6	Very high	95.1	Very high	4 Å²	4	39.4 Å²	39.4	3%	0.027	22%	0.223	C	C	.	.			trans	-58.9	131.7	177.3	177.6	0	0	0	0	110.4	A184 H188 L189 G190 C191 P193 C205 Y212	A184-C186 PolarHBondContact O-N 2.83Å; C186-H188 PolarHBondContact O-N 3.48Å; C186-L189 PolarHBondContact O-N 2.87Å; C186-G190 WeakPolarHBondContact O-CA 3.48Å; C186-G190 PolarHBondContact O-N 3.39Å; C186-C191 WeakPolarHBondContact CB-O 3.49Å; C186-C191 PolarHBondContact N-O 3.46Å; C186-P193 HydrophobicContact CB-CG 4.14Å; C186-C205 HydrophobicContact CB-CB 4.33Å; C186-C205 VanDerWaalsContact SG-SG 3.67Å; C186-Y212 PolarHBondContact SG-OH 2.97Å
187	T	96.6	Very high	95.2	Very high	44 Å²	44	38.3 Å²	38.3	27%	0.27	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-4.2	-176.3	61.4	0	0	0	0	114.3	P185 Y212 P224 R225 N226	P185-T187 PolarHBondContact O-N 3.14Å; T187-Y212 PolarHBondContact N-OH 3.12Å; T187-P224 WeakPolarHBondContact O-CD 3.28Å; T187-R225 HydrophobicContact CG2-CB 4.22Å; T187-R225 PolarHBondContact OG1-N 3.35Å; T187-R225 PolarHBondContact OG1-O 3.4Å; T187-N226 WeakPolarHBondContact CG2-O 3.43Å
188	H	96.1	Very high	95.2	Very high	59 Å²	59	36.8 Å²	36.8	27%	0.273	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.1	-69.8	171	-174.5	-137.4	0	0	0	111.4	C186 H208 A223	C186-H188 PolarHBondContact O-N 3.48Å; H188-H208 AromaticContact CE1-CD2 3.95Å; H188-H208 AromaticContact CE1-CE1 3.87Å; H188-H208 AromaticContact CE1-CG 3.48Å; H188-H208 VanDerWaalsContact CE1-CG 3.48Å; H188-H208 AromaticContact CE1-ND1 3.42Å; H188-H208 PolarHBondContact CE1-ND1 3.21Å; H188-H208 AromaticContact ND1-CE1 3.94Å; H188-H208 AromaticContact ND1-CG 3.56Å; H188-H208 AromaticContact ND1-ND1 3.21Å; H188-H208 PolarHBondContact ND1-ND1 2.87Å; H188-A223 HydrophobicContact CB-CB 4.02Å
189	L	95.2	Very high	95.1	Very high	121 Å²	121	38.4 Å²	38.4	63%	0.634	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	-143.9	21.8	-173.1	-68	174.8	0	0	0	112.9	C186 C191	C186-L189 PolarHBondContact O-N 2.87Å; L189-C191 PolarHBondContact O-N 3.27Å
190	G	94.6	Very high	95	Very high	43 Å²	43	41.1 Å²	41.1	44%	0.443	24%	0.241	S	C	.	.	S	Bend	trans	83.1	0.7	169	0	0	0	0	0	117.3	C186	C186-G190 WeakPolarHBondContact O-CA 3.48Å; C186-G190 PolarHBondContact O-N 3.39Å
191	C	95.1	Very high	94.8	Very high	36 Å²	36	42.3 Å²	42.3	24%	0.243	25%	0.253	C	S	.	.			trans	-59.2	154.7	172.8	-66.6	0	0	0	0	112.3	C186 L189 P193 C207	C186-C191 WeakPolarHBondContact CB-O 3.49Å; C186-C191 PolarHBondContact N-O 3.46Å; L189-C191 PolarHBondContact O-N 3.27Å; C191-P193 VanDerWaalsContact O-CD 3.31Å; C191-P193 WeakPolarHBondContact O-CD 3.49Å; C191-C207 HydrophobicContact CB-CB 4Å; C191-C207 WeakPolarHBondContact CB-SG 3.28Å; C191-C207 WeakPolarHBondContact SG-CB 3.48Å; C191-C207 CovalentContact SG-SG 2.04Å; C191-C207 PolarHBondContact SG-SG 3.31Å
192	V	95.5	Very high	94.7	Very high	72 Å²	72	42.3 Å²	42.3	44%	0.436	25%	0.253	S	S	.	.			trans	-87.4	115.9	176.7	-177.7	0	0	0	0	110.1	P142 F144 A184	P142-V192 HydrophobicContact CG-CG1 4.34Å; P142-V192 HydrophobicContact CG-CG2 3.58Å; F144-V192 HydrophobicContact CE1-CG1 4.39Å; F144-V192 HydrophobicContact CZ-CG1 3.81Å; A184-V192 HydrophobicContact CB-CG1 4.2Å
193	P	96.6	Very high	94.7	Very high	2 Å²	2	42.3 Å²	42.3	1%	0.013	25%	0.253	C	S	.	.	P	Polyproline II helix	trans	-64.4	143.9	172	-22.5	35.7	0	0	0	112	F144 A184 C186 C191 F204 C205 Y212 L227	F144-P193 VanDerWaalsContact CZ-O 3.23Å; F144-P193 WeakPolarHBondContact CZ-O 3.47Å; A184-P193 WeakPolarHBondContact O-CD 3.27Å; C186-P193 HydrophobicContact CB-CG 4.14Å; C191-P193 VanDerWaalsContact O-CD 3.31Å; C191-P193 WeakPolarHBondContact O-CD 3.49Å; P193-F204 CarbonylContact C-O 3.58Å; P193-F204 WeakPolarHBondContact CA-O 3.24Å; P193-C205 HydrophobicContact CB-CB 4.47Å; P193-C205 HydrophobicContact CG-CB 4.33Å; P193-Y212 HydrophobicContact CG-CD2 4.47Å; P193-Y212 HydrophobicContact CG-CE2 4.19Å; P193-L227 HydrophobicContact CG-CD2 4.42Å
194	V	96	Very high	94.8	Very high	72 Å²	72	44.8 Å²	44.8	44%	0.436	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	124.8	173.7	-178.2	0	0	0	0	108.7	A197 Y203 F204	V194-A197 HydrophobicContact CB-CB 4.2Å; V194-A197 HydrophobicContact CG1-CB 4.08Å; V194-Y203 CarbonylContact O-C 3.58Å; V194-Y203 VanDerWaalsContact O-CA 3.32Å; V194-Y203 WeakPolarHBondContact O-CA 3.44Å; V194-F204 PolarHBondContact N-O 2.93Å; V194-F204 PolarHBondContact O-N 3.38Å
195	P	95.1	Very high	94.9	Very high	39 Å²	39	44.9 Å²	44.9	25%	0.253	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	153.2	177.2	30.6	-35.8	0	0	0	111.6	N133 A197 Y203	N133-P195 HydrophobicContact CB-CB 3.92Å; N133-P195 HydrophobicContact CB-CG 4.38Å; P195-A197 PolarHBondContact O-N 3.02Å; P195-Y203 HydrophobicContact CB-CD1 3.94Å; P195-Y203 HydrophobicContact CB-CE1 3.9Å
196	Y	92.8	Very high	94.9	Very high	96 Å²	96	47 Å²	47	38%	0.376	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.9	21	-179.3	-53	-76.9	0	0	0	114.7	G131 K132 N133 G202	G131-Y196 PolarHBondContact O-OH 3.02Å; K132-Y196 VanDerWaalsContact CA-OH 3.29Å; K132-Y196 WeakPolarHBondContact CA-OH 3.44Å; K132-Y196 PolarHBondContact N-OH 2.99Å; K132-Y196 PolarHBondContact O-OH 3.48Å; N133-Y196 HydrophobicContact CB-CE2 3.64Å; N133-Y196 PolarHBondContact N-OH 3.4Å; Y196-G202 PolarHBondContact N-O 3.47Å
197	A	93.2	Very high	94.9	Very high	26 Å²	26	49.7 Å²	49.7	22%	0.215	30%	0.296	C	S	.	.			trans	-118.4	159.7	177	0	0	0	0	0	111.3	V194 P195 Y203 F204	V194-A197 HydrophobicContact CB-CB 4.2Å; V194-A197 HydrophobicContact CG1-CB 4.08Å; P195-A197 PolarHBondContact O-N 3.02Å; A197-Y203 CarbonylContact O-C 3.37Å; A197-F204 HydrophobicContact CB-CB 3.66Å; A197-F204 PolarHBondContact O-N 3.5Å
198	G	93	Very high	94.9	Very high	33 Å²	33	52.2 Å²	52.2	34%	0.34	31%	0.305	S	S	.	.	S	Bend	trans	87.3	164.1	179.8	0	0	0	0	0	114.3	Y200 G201 H211	G198-Y200 PolarHBondContact O-N 2.7Å; G198-G201 PolarHBondContact O-N 3.11Å; G198-G201 VanDerWaalsContact O-N 3.13Å; G198-H211 WeakPolarHBondContact CA-ND1 3.41Å
199	D	93.6	Very high	94.9	Very high	98 Å²	98	50.6 Å²	50.6	52%	0.524	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.9	-24.3	-173.6	-51.7	-9.1	0	0	0	116	H211 R220	D199-H211 VanDerWaalsContact CG-CE1 3.47Å; D199-H211 PolarHBondContact N-ND1 3.44Å; D199-H211 VanDerWaalsContact N-ND1 3.14Å; D199-H211 IonicContact OD1-CE1 3.71Å; D199-H211 PolarHBondContact OD1-CE1 2.78Å; D199-H211 VanDerWaalsContact OD1-CE1 3.27Å; D199-H211 IonicContact OD1-ND1 2.81Å; D199-H211 IonicContact OD2-CE1 2.73Å; D199-H211 IonicContact OD2-ND1 3.78Å; D199-R220 IonicContact OD2-CZ 3.8Å; D199-R220 IonicContact OD2-NH1 3.72Å; D199-R220 PolarHBondContact OD2-NH1 2.94Å
200	Y	93.4	Very high	95	Very high	76 Å²	76	44.9 Å²	44.9	30%	0.298	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.9	8.2	-173.9	-56.7	-83.5	0	0	0	114	G198 G202 H211 R219 R220	G198-Y200 PolarHBondContact O-N 2.7Å; Y200-G202 PolarHBondContact O-N 3.34Å; Y200-G202 VanDerWaalsContact O-N 3.09Å; Y200-H211 HydrophobicContact CD2-CB 3.88Å; Y200-H211 HydrophobicContact CE2-CB 4.16Å; Y200-R219 HydrophobicContact CD1-CB 4.18Å; Y200-R219 HydrophobicContact CD1-CG 4.02Å; Y200-R219 HydrophobicContact CD2-CB 3.43Å; Y200-R219 VanDerWaalsContact CD2-CB 3.43Å; Y200-R219 HydrophobicContact CD2-CG 3.82Å; Y200-R219 HydrophobicContact CE1-CB 3.99Å; Y200-R219 HydrophobicContact CE1-CG 4.24Å; Y200-R219 HydrophobicContact CE2-CB 3.23Å; Y200-R219 HydrophobicContact CE2-CG 4.07Å; Y200-R219 HydrophobicContact CG-CB 3.92Å; Y200-R219 HydrophobicContact CG-CG 3.8Å; Y200-R220 HydrophobicContact CE2-CB 4.12Å
201	G	90.2	Very high	95.1	Very high	25 Å²	25	43.7 Å²	43.7	26%	0.258	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	63.3	17	176.5	0	0	0	0	0	115.1	R146 G198	R146-G201 PolarHBondContact NH2-O 3Å; G198-G201 PolarHBondContact O-N 3.11Å; G198-G201 VanDerWaalsContact O-N 3.13Å
202	G	93.6	Very high	95.2	Very high	0 Å²	0	42 Å²	42	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	-94.7	178.2	0	0	0	0	0	111.1	R146 Y196 Y200 Y212 D213	R146-G202 PolarHBondContact NH1-O 3.18Å; Y196-G202 PolarHBondContact N-O 3.47Å; Y200-G202 PolarHBondContact O-N 3.34Å; Y200-G202 VanDerWaalsContact O-N 3.09Å; G202-Y212 VanDerWaalsContact CA-O 3.28Å; G202-Y212 WeakPolarHBondContact CA-O 3.47Å; G202-Y212 PolarHBondContact N-O 3.37Å; G202-D213 VanDerWaalsContact CA-O 3.31Å; G202-D213 WeakPolarHBondContact CA-O 3.44Å
203	Y	96.8	Very high	95.2	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	142.7	-178.3	-51.5	-97	0	0	0	111.6	N133 F144 L182 V194 P195 A197 Y212 L227	N133-Y203 PolarHBondContact OD1-OH 2.9Å; N133-Y203 VanDerWaalsContact OD1-OH 3.11Å; F144-Y203 HydrophobicContact CB-CE1 4.36Å; F144-Y203 AromaticContact CD2-CD1 3.88Å; F144-Y203 HydrophobicContact CD2-CD1 3.88Å; F144-Y203 AromaticContact CD2-CE1 3.46Å; F144-Y203 HydrophobicContact CD2-CE1 3.46Å; F144-Y203 VanDerWaalsContact CD2-CE1 3.46Å; F144-Y203 AromaticContact CE2-CD1 3.76Å; F144-Y203 HydrophobicContact CE2-CD1 3.76Å; F144-Y203 AromaticContact CE2-CE1 3.82Å; F144-Y203 HydrophobicContact CE2-CE1 3.82Å; F144-Y203 AromaticContact CG-CE1 3.94Å; F144-Y203 HydrophobicContact CG-CE1 3.94Å; F144-Y203 HydrophobicContact CZ-CD1 4.49Å; L182-Y203 HydrophobicContact CD1-CE2 3.88Å; V194-Y203 CarbonylContact O-C 3.58Å; V194-Y203 VanDerWaalsContact O-CA 3.32Å; V194-Y203 WeakPolarHBondContact O-CA 3.44Å; P195-Y203 HydrophobicContact CB-CD1 3.94Å; P195-Y203 HydrophobicContact CB-CE1 3.9Å; A197-Y203 CarbonylContact O-C 3.37Å; Y203-Y212 PolarHBondContact N-O 2.85Å; Y203-Y212 PolarHBondContact O-N 3.4Å; Y203-L227 HydrophobicContact CD2-CD1 4.21Å; Y203-L227 HydrophobicContact CG-CD1 4.39Å
204	F	97.2	Very high	95	Very high	59 Å²	59	38.6 Å²	38.6	26%	0.259	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	124	177.6	173.7	-108.1	0	0	0	111.7	P193 V194 A197 P206 H211	P193-F204 CarbonylContact C-O 3.58Å; P193-F204 WeakPolarHBondContact CA-O 3.24Å; V194-F204 PolarHBondContact N-O 2.93Å; V194-F204 PolarHBondContact O-N 3.38Å; A197-F204 HydrophobicContact CB-CB 3.66Å; A197-F204 PolarHBondContact O-N 3.5Å; F204-P206 HydrophobicContact CE1-CB 4.07Å; F204-P206 VanDerWaalsContact O-CD 3.31Å; F204-P206 WeakPolarHBondContact O-CD 3.34Å; F204-H211 AromaticContact CD2-CE1 3.65Å; F204-H211 AromaticContact CD2-ND1 3.82Å; F204-H211 AromaticContact CD2-NE2 3.75Å; F204-H211 AromaticContact CE2-CE1 3.74Å; F204-H211 AromaticContact CE2-NE2 3.52Å
205	C	97	Very high	95	Very high	3 Å²	3	35.1 Å²	35.1	2%	0.02	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	108	176	177.4	0	0	0	0	110.6	C186 P193 C207 G209 S210	C186-C205 HydrophobicContact CB-CB 4.33Å; C186-C205 VanDerWaalsContact SG-SG 3.67Å; P193-C205 HydrophobicContact CB-CB 4.47Å; P193-C205 HydrophobicContact CG-CB 4.33Å; C205-C207 VanDerWaalsContact C-N 3.25Å; C205-C207 PolarHBondContact O-N 2.8Å; C205-G209 WeakPolarHBondContact O-CA 3.44Å; C205-G209 PolarHBondContact O-N 3.42Å; C205-G209 VanDerWaalsContact O-N 3.11Å; C205-S210 PolarHBondContact N-O 3.4Å; C205-S210 PolarHBondContact O-N 3.28Å
206	P	95.8	Very high	95	Very high	80 Å²	80	33.3 Å²	33.3	52%	0.519	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.8	-19.4	-174.1	28	-35.9	0	0	0	114.1	F204 H208	F204-P206 HydrophobicContact CE1-CB 4.07Å; F204-P206 VanDerWaalsContact O-CD 3.31Å; F204-P206 WeakPolarHBondContact O-CD 3.34Å; P206-H208 PolarHBondContact O-N 3.21Å
207	C	96.3	Very high	95.2	Very high	60 Å²	60	28.8 Å²	28.8	41%	0.405	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-44.9	-175.4	-63.9	0	0	0	0	113.6	C191 C205	C191-C207 HydrophobicContact CB-CB 4Å; C191-C207 WeakPolarHBondContact CB-SG 3.28Å; C191-C207 WeakPolarHBondContact SG-CB 3.48Å; C191-C207 CovalentContact SG-SG 2.04Å; C191-C207 PolarHBondContact SG-SG 3.31Å; C205-C207 VanDerWaalsContact C-N 3.25Å; C205-C207 PolarHBondContact O-N 2.8Å
208	H	96.5	Very high	95.4	Very high	97 Å²	97	27.5 Å²	27.5	45%	0.449	16%	0.163	S	C	.	.	T	Hydrogen-bonded Turn	trans	-141.8	19.9	-176.8	-53.7	92.4	0	0	0	112.5	H188 P206 P222	H188-H208 AromaticContact CE1-CD2 3.95Å; H188-H208 AromaticContact CE1-CE1 3.87Å; H188-H208 AromaticContact CE1-CG 3.48Å; H188-H208 VanDerWaalsContact CE1-CG 3.48Å; H188-H208 AromaticContact CE1-ND1 3.42Å; H188-H208 PolarHBondContact CE1-ND1 3.21Å; H188-H208 AromaticContact ND1-CE1 3.94Å; H188-H208 AromaticContact ND1-CG 3.56Å; H188-H208 AromaticContact ND1-ND1 3.21Å; H188-H208 PolarHBondContact ND1-ND1 2.87Å; P206-H208 PolarHBondContact O-N 3.21Å; H208-P222 HydrophobicContact CB-CG 3.65Å; H208-P222 WeakPolarHBondContact O-CD 3.2Å
209	G	95.2	Very high	95.4	Very high	25 Å²	25	28.7 Å²	28.7	26%	0.258	16%	0.158	S	C	.	.	T	Hydrogen-bonded Turn	trans	66.5	42.8	175.2	0	0	0	0	0	114.9	C205 H211	C205-G209 WeakPolarHBondContact O-CA 3.44Å; C205-G209 PolarHBondContact O-N 3.42Å; C205-G209 VanDerWaalsContact O-N 3.11Å; G209-H211 PolarHBondContact O-CD2 3.08Å; G209-H211 VanDerWaalsContact O-CD2 3.25Å
210	S	96.6	Very high	95.5	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86	130.8	171.6	-58.7	0	0	0	0	110.7	C205 R220 P222 A223	C205-S210 PolarHBondContact N-O 3.4Å; C205-S210 PolarHBondContact O-N 3.28Å; S210-R220 CarbonylContact C-O 3.54Å; S210-R220 WeakPolarHBondContact CA-O 3.44Å; S210-P222 VanDerWaalsContact OG-CD 3.29Å; S210-P222 WeakPolarHBondContact OG-CD 3.06Å; S210-A223 PolarHBondContact OG-N 2.84Å
211	H	97.2	Very high	95.5	Very high	19 Å²	19	28.1 Å²	28.1	9%	0.088	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	127.2	-179.7	-59.7	-118.4	0	0	0	110.5	G198 D199 Y200 F204 G209 I218 R219 R220	G198-H211 WeakPolarHBondContact CA-ND1 3.41Å; D199-H211 VanDerWaalsContact CG-CE1 3.47Å; D199-H211 PolarHBondContact N-ND1 3.44Å; D199-H211 VanDerWaalsContact N-ND1 3.14Å; D199-H211 IonicContact OD1-CE1 3.71Å; D199-H211 PolarHBondContact OD1-CE1 2.78Å; D199-H211 VanDerWaalsContact OD1-CE1 3.27Å; D199-H211 IonicContact OD1-ND1 2.81Å; D199-H211 IonicContact OD2-CE1 2.73Å; D199-H211 IonicContact OD2-ND1 3.78Å; Y200-H211 HydrophobicContact CD2-CB 3.88Å; Y200-H211 HydrophobicContact CE2-CB 4.16Å; F204-H211 AromaticContact CD2-CE1 3.65Å; F204-H211 AromaticContact CD2-ND1 3.82Å; F204-H211 AromaticContact CD2-NE2 3.75Å; F204-H211 AromaticContact CE2-CE1 3.74Å; F204-H211 AromaticContact CE2-NE2 3.52Å; G209-H211 PolarHBondContact O-CD2 3.08Å; G209-H211 VanDerWaalsContact O-CD2 3.25Å; H211-I218 WeakPolarHBondContact O-CD1 3.26Å; H211-R219 PolarHBondContact O-N 3.12Å; H211-R220 HydrophobicContact CB-CB 4.09Å; H211-R220 PolarHBondContact N-O 3.08Å; H211-R220 PolarHBondContact O-N 2.83Å
212	Y	97.1	Very high	95.8	Very high	1 Å²	1	30 Å²	30	0%	0.004	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	149.2	176.1	-58	-91.6	0	0	0	110.4	C186 T187 P193 G202 Y203 G216 R217 I218 A223 L227	C186-Y212 PolarHBondContact SG-OH 2.97Å; T187-Y212 PolarHBondContact N-OH 3.12Å; P193-Y212 HydrophobicContact CG-CD2 4.47Å; P193-Y212 HydrophobicContact CG-CE2 4.19Å; G202-Y212 VanDerWaalsContact CA-O 3.28Å; G202-Y212 WeakPolarHBondContact CA-O 3.47Å; G202-Y212 PolarHBondContact N-O 3.37Å; Y203-Y212 PolarHBondContact N-O 2.85Å; Y203-Y212 PolarHBondContact O-N 3.4Å; Y212-G216 WeakPolarHBondContact CD1-O 3.12Å; Y212-R217 CarbonylContact C-O 3.59Å; Y212-R217 WeakPolarHBondContact CA-O 3.37Å; Y212-I218 HydrophobicContact CD1-CB 4.06Å; Y212-I218 HydrophobicContact CD1-CD1 4.23Å; Y212-I218 HydrophobicContact CE1-CB 3.84Å; Y212-I218 HydrophobicContact CE1-CD1 3.94Å; Y212-I218 HydrophobicContact CE1-CG1 4.39Å; Y212-A223 VanDerWaalsContact OH-CB 3.23Å; Y212-A223 WeakPolarHBondContact OH-CB 3.47Å; Y212-L227 HydrophobicContact CD1-CD1 4.31Å; Y212-L227 HydrophobicContact CD1-CD2 4.37Å; Y212-L227 HydrophobicContact CD1-CG 3.8Å; Y212-L227 HydrophobicContact CE1-CD2 3.86Å; Y212-L227 HydrophobicContact CE1-CG 3.74Å; Y212-L227 HydrophobicContact CE2-CD2 4.21Å; Y212-L227 HydrophobicContact CG-CD1 4.26Å; Y212-L227 HydrophobicContact CG-CG 4.22Å
213	D	95.2	Very high	96	Very high	1 Å²	1	30 Å²	30	1%	0.005	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	-178.8	173.6	67.5	15.9	0	0	0	112.8	E156 G202 S215 G216 R217 R219	E156-D213 WeakPolarHBondContact OE2-CB 3.12Å; G202-D213 VanDerWaalsContact CA-O 3.31Å; G202-D213 WeakPolarHBondContact CA-O 3.44Å; D213-S215 PolarHBondContact O-N 3.37Å; D213-S215 VanDerWaalsContact O-N 3.11Å; D213-S215 WeakPolarHBondContact OD1-CA 3.35Å; D213-S215 WeakPolarHBondContact OD1-CB 3.39Å; D213-S215 PolarHBondContact OD1-N 3.23Å; D213-G216 PolarHBondContact O-N 3.01Å; D213-G216 PolarHBondContact OD1-N 2.93Å; D213-R217 PolarHBondContact N-O 3.27Å; D213-R217 WeakPolarHBondContact OD1-CB 3.3Å; D213-R217 PolarHBondContact OD1-N 3.3Å; D213-R217 IonicContact OD1-NE 3.36Å; D213-R217 PolarHBondContact OD1-NE 3.46Å; D213-R217 IonicContact OD2-CZ 3.52Å; D213-R217 VanDerWaalsContact OD2-CZ 3.31Å; D213-R217 IonicContact OD2-NE 3.57Å; D213-R217 PolarHBondContact OD2-NE 3.47Å; D213-R217 IonicContact OD2-NH2 3.9Å; D213-R217 PolarHBondContact OD2-NH2 3.03Å; D213-R217 VanDerWaalsContact OD2-NH2 3.11Å; D213-R219 HydrophobicContact CB-CG 3.88Å; D213-R219 IonicContact OD2-NH1 2.81Å; D213-R219 PolarHBondContact OD2-NH1 3.34Å
214	G	94	Very high	95.9	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-4.4	-178.9	0	0	0	0	0	114.8	E156 L180	E156-G214 VanDerWaalsContact CD-N 3.28Å; E156-G214 VanDerWaalsContact OE1-CA 3.31Å; E156-G214 WeakPolarHBondContact OE1-CA 3.43Å; E156-G214 PolarHBondContact OE1-N 3.4Å; E156-G214 PolarHBondContact OE2-N 3.44Å; L180-G214 WeakPolarHBondContact CD2-O 3.49Å
215	S	95.5	Very high	95.8	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.7	-0.5	171.1	-168.5	0	0	0	0	112.2	D170 R173 D213 R217	D170-S215 WeakPolarHBondContact OD1-CB 3.46Å; D170-S215 PolarHBondContact OD1-OG 3.02Å; R173-S215 VanDerWaalsContact CZ-O 3.32Å; R173-S215 PolarHBondContact NE-O 2.99Å; R173-S215 PolarHBondContact NE-OG 3.31Å; R173-S215 PolarHBondContact NH2-O 3.34Å; D213-S215 PolarHBondContact O-N 3.37Å; D213-S215 VanDerWaalsContact O-N 3.11Å; D213-S215 WeakPolarHBondContact OD1-CA 3.35Å; D213-S215 WeakPolarHBondContact OD1-CB 3.39Å; D213-S215 PolarHBondContact OD1-N 3.23Å; S215-R217 VanDerWaalsContact C-N 3.33Å
216	G	95.5	Very high	95.8	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	21%	0.205	C	C	.	.			trans	76.3	19.1	-175.2	0	0	0	0	0	113.6	Y212 D213 L227	Y212-G216 WeakPolarHBondContact CD1-O 3.12Å; D213-G216 PolarHBondContact O-N 3.01Å; D213-G216 PolarHBondContact OD1-N 2.93Å; G216-L227 WeakPolarHBondContact O-CB 3.26Å; G216-L227 PolarHBondContact O-N 3.37Å
217	R	96.6	Very high	95.8	Very high	1 Å²	1	35.3 Å²	35.3	0%	0.004	18%	0.18	C	C	.	.			trans	-86.5	140.8	178.7	-55.9	170.1	-65	-163.8	-10	110.5	E156 Q168 Y212 D213 S215 R219 N226	E156-R217 PolarHBondContact O-NH2 3.41Å; E156-R217 IonicContact OE2-NH2 3.27Å; E156-R217 PolarHBondContact OE2-NH2 3.31Å; Q168-R217 VanDerWaalsContact O-CD 3.24Å; Q168-R217 WeakPolarHBondContact O-CD 3.37Å; Q168-R217 PolarHBondContact O-NH1 3.41Å; Y212-R217 CarbonylContact C-O 3.59Å; Y212-R217 WeakPolarHBondContact CA-O 3.37Å; D213-R217 PolarHBondContact N-O 3.27Å; D213-R217 WeakPolarHBondContact OD1-CB 3.3Å; D213-R217 PolarHBondContact OD1-N 3.3Å; D213-R217 IonicContact OD1-NE 3.36Å; D213-R217 PolarHBondContact OD1-NE 3.46Å; D213-R217 IonicContact OD2-CZ 3.52Å; D213-R217 VanDerWaalsContact OD2-CZ 3.31Å; D213-R217 IonicContact OD2-NE 3.57Å; D213-R217 PolarHBondContact OD2-NE 3.47Å; D213-R217 IonicContact OD2-NH2 3.9Å; D213-R217 PolarHBondContact OD2-NH2 3.03Å; D213-R217 VanDerWaalsContact OD2-NH2 3.11Å; S215-R217 VanDerWaalsContact C-N 3.33Å; R217-R219 PolarHBondContact O-N 2.85Å; R217-N226 WeakPolarHBondContact CA-OD1 3.46Å; R217-N226 WeakPolarHBondContact CB-OD1 3.23Å
218	I	96.4	Very high	95.8	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	122.7	-178.3	-177.6	59.2	0	0	0	110.3	R165 D166 H211 Y212 R220 A223 N226	R165-I218 HydrophobicContact CB-CG2 4.25Å; R165-I218 VanDerWaalsContact NH1-CG1 3.27Å; D166-I218 HydrophobicContact CB-CG2 4.4Å; H211-I218 WeakPolarHBondContact O-CD1 3.26Å; Y212-I218 HydrophobicContact CD1-CB 4.06Å; Y212-I218 HydrophobicContact CD1-CD1 4.23Å; Y212-I218 HydrophobicContact CE1-CB 3.84Å; Y212-I218 HydrophobicContact CE1-CD1 3.94Å; Y212-I218 HydrophobicContact CE1-CG1 4.39Å; I218-R220 WeakPolarHBondContact CD1-O 3.21Å; I218-A223 HydrophobicContact CD1-CB 3.79Å; I218-A223 HydrophobicContact CG1-CB 4.07Å; I218-A223 WeakPolarHBondContact CG1-O 3.1Å; I218-N226 WeakPolarHBondContact CG2-OD1 3.43Å; I218-N226 PolarHBondContact N-OD1 2.98Å
219	R	94.8	Very high	95.7	Very high	58 Å²	58	35.9 Å²	35.9	22%	0.219	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	-37.9	-178.8	-57.3	-59.9	-68.5	-90.7	-1.5	112.7	Y200 H211 D213 R217	Y200-R219 HydrophobicContact CD1-CB 4.18Å; Y200-R219 HydrophobicContact CD1-CG 4.02Å; Y200-R219 HydrophobicContact CD2-CB 3.43Å; Y200-R219 VanDerWaalsContact CD2-CB 3.43Å; Y200-R219 HydrophobicContact CD2-CG 3.82Å; Y200-R219 HydrophobicContact CE1-CB 3.99Å; Y200-R219 HydrophobicContact CE1-CG 4.24Å; Y200-R219 HydrophobicContact CE2-CB 3.23Å; Y200-R219 HydrophobicContact CE2-CG 4.07Å; Y200-R219 HydrophobicContact CG-CB 3.92Å; Y200-R219 HydrophobicContact CG-CG 3.8Å; H211-R219 PolarHBondContact O-N 3.12Å; D213-R219 HydrophobicContact CB-CG 3.88Å; D213-R219 IonicContact OD2-NH1 2.81Å; D213-R219 PolarHBondContact OD2-NH1 3.34Å; R217-R219 PolarHBondContact O-N 2.85Å
220	R	94.1	Very high	95.6	Very high	138 Å²	138	35 Å²	35	52%	0.521	17%	0.169	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	152	-176.7	-172.4	179.9	179.7	-170.9	0.7	111.1	D199 Y200 S210 H211 I218	D199-R220 IonicContact OD2-CZ 3.8Å; D199-R220 IonicContact OD2-NH1 3.72Å; D199-R220 PolarHBondContact OD2-NH1 2.94Å; Y200-R220 HydrophobicContact CE2-CB 4.12Å; S210-R220 CarbonylContact C-O 3.54Å; S210-R220 WeakPolarHBondContact CA-O 3.44Å; H211-R220 HydrophobicContact CB-CB 4.09Å; H211-R220 PolarHBondContact N-O 3.08Å; H211-R220 PolarHBondContact O-N 2.83Å; I218-R220 WeakPolarHBondContact CD1-O 3.21Å
221	G	94.7	Very high	95.4	Very high	23 Å²	23	40.3 Å²	40.3	24%	0.237	19%	0.194	C	C	.	.	S	Bend	trans	97.2	-174.8	175.8	0	0	0	0	0	113.5	R165	R165-G221 VanDerWaalsContact CZ-O 3.27Å; R165-G221 PolarHBondContact NH1-O 3.05Å; R165-G221 PolarHBondContact NH2-O 2.95Å
222	P	96.5	Very high	95.2	Very high	64 Å²	64	40.3 Å²	40.3	42%	0.416	19%	0.194	S	C	.	.	S	Bend	trans	-80.1	-11.7	-167.9	29.7	-37.5	0	0	0	115.9	H208 S210	H208-P222 HydrophobicContact CB-CG 3.65Å; H208-P222 WeakPolarHBondContact O-CD 3.2Å; S210-P222 VanDerWaalsContact OG-CD 3.29Å; S210-P222 WeakPolarHBondContact OG-CD 3.06Å
223	A	96.6	Very high	95	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	21%	0.209	C	C	.	.			trans	-60.7	129.9	-179.5	0	0	0	0	0	112.1	R165 H188 S210 Y212 I218	R165-A223 PolarHBondContact NH1-O 3.3Å; H188-A223 HydrophobicContact CB-CB 4.02Å; S210-A223 PolarHBondContact OG-N 2.84Å; Y212-A223 VanDerWaalsContact OH-CB 3.23Å; Y212-A223 WeakPolarHBondContact OH-CB 3.47Å; I218-A223 HydrophobicContact CD1-CB 3.79Å; I218-A223 HydrophobicContact CG1-CB 4.07Å; I218-A223 WeakPolarHBondContact CG1-O 3.1Å
224	P	94.9	Very high	94.8	Very high	72 Å²	72	44.5 Å²	44.5	47%	0.468	22%	0.218	S	C	.	.			trans	-78.7	-26.5	-173.1	29	-34.8	0	0	0	114	T187	T187-P224 WeakPolarHBondContact O-CD 3.28Å
225	R	95.9	Very high	94.6	Very high	175 Å²	175	49.8 Å²	49.8	66%	0.66	24%	0.241	S	C	*	.	S	Bend	trans	-135.3	163.4	-170.1	-63.2	-176.6	-175.3	170.2	0.7	112.8	T187	T187-R225 HydrophobicContact CG2-CB 4.22Å; T187-R225 PolarHBondContact OG1-N 3.35Å; T187-R225 PolarHBondContact OG1-O 3.4Å
226	N	96.8	Very high	94.2	Very high	8 Å²	8	54.3 Å²	54.3	4%	0.043	27%	0.265	C	S	.	.	P	Polyproline II helix	trans	-62.1	157	170.5	-61	-27.6	0	0	0	111.3	D166 Q168 T187 R217 I218 E228	D166-N226 PolarHBondContact O-ND2 3.15Å; D166-N226 VanDerWaalsContact OD2-CG 3.29Å; D166-N226 PolarHBondContact OD2-N 3.39Å; D166-N226 PolarHBondContact OD2-ND2 2.99Å; Q168-N226 PolarHBondContact OE1-ND2 3.32Å; T187-N226 WeakPolarHBondContact CG2-O 3.43Å; R217-N226 WeakPolarHBondContact CA-OD1 3.46Å; R217-N226 WeakPolarHBondContact CB-OD1 3.23Å; I218-N226 WeakPolarHBondContact CG2-OD1 3.43Å; I218-N226 PolarHBondContact N-OD1 2.98Å; N226-E228 PolarHBondContact O-N 3.03Å
227	L	96.6	Very high	93.8	Very high	0 Å²	0	60.7 Å²	60.7	0%	0	30%	0.299	C	S	.	.	P	Polyproline II helix	trans	-59.7	136.8	171.3	-65.7	177.4	0	0	0	109.7	R173 L182 P193 Y203 Y212 G216	R173-L227 PolarHBondContact NH1-O 3Å; R173-L227 PolarHBondContact NH2-O 3.15Å; L182-L227 HydrophobicContact CB-CB 4.45Å; L182-L227 HydrophobicContact CD1-CB 4.37Å; L182-L227 HydrophobicContact CD1-CD1 4.18Å; L182-L227 HydrophobicContact CD2-CB 4.29Å; P193-L227 HydrophobicContact CG-CD2 4.42Å; Y203-L227 HydrophobicContact CD2-CD1 4.21Å; Y203-L227 HydrophobicContact CG-CD1 4.39Å; Y212-L227 HydrophobicContact CD1-CD1 4.31Å; Y212-L227 HydrophobicContact CD1-CD2 4.37Å; Y212-L227 HydrophobicContact CD1-CG 3.8Å; Y212-L227 HydrophobicContact CE1-CD2 3.86Å; Y212-L227 HydrophobicContact CE1-CG 3.74Å; Y212-L227 HydrophobicContact CE2-CD2 4.21Å; Y212-L227 HydrophobicContact CG-CD1 4.26Å; Y212-L227 HydrophobicContact CG-CG 4.22Å; G216-L227 WeakPolarHBondContact O-CB 3.26Å; G216-L227 PolarHBondContact O-N 3.37Å
228	E	95.1	Very high	93.5	Very high	122 Å²	122	68.2 Å²	68.2	57%	0.57	33%	0.328	S	S	*	.	P	Polyproline II helix	trans	-69.6	131.9	-175.6	-176	177.9	172.6	0	0	110.2	L183 N226	L183-E228 HydrophobicContact CB-CB 4.26Å; L183-E228 HydrophobicContact CD1-CB 4.12Å; L183-E228 HydrophobicContact CD1-CG 3.94Å; L183-E228 HydrophobicContact CG-CB 4.41Å; L183-E228 PolarHBondContact N-O 3.07Å; N226-E228 PolarHBondContact O-N 3.03Å
229	V	95	Very high	93.3	Very high	46 Å²	46	69.4 Å²	69.4	28%	0.279	34%	0.335	S	S	.	.	P	Polyproline II helix	trans	-89	116.4	172.1	-179.2	0	0	0	0	106.6	R173 L182 Y232	R173-V229 HydrophobicContact CB-CG2 4.15Å; R173-V229 WeakPolarHBondContact O-CG1 3.06Å; L182-V229 HydrophobicContact CD2-CG2 3.8Å; V229-Y232 HydrophobicContact CG1-CD1 4.42Å; V229-Y232 HydrophobicContact CG1-CE1 3.72Å
230	P	93.3	Very high	93.2	Very high	7 Å²	7	66.7 Å²	66.7	5%	0.045	33%	0.325	C	S	.	.	P	Polyproline II helix	trans	-68.3	162	176.9	30	-33	0	0	0	110.4	W138 V143 I181 L183 Y232 I242	W138-P230 HydrophobicContact CZ3-CB 4.16Å; V143-P230 HydrophobicContact CG1-CG 4.4Å; I181-P230 HydrophobicContact CG2-CG 3.74Å; L183-P230 HydrophobicContact CD2-CB 3.92Å; L183-P230 HydrophobicContact CD2-CG 4.11Å; L183-P230 HydrophobicContact CG-CB 4.13Å; L183-P230 HydrophobicContact CG-CG 4.34Å; P230-Y232 WeakPolarHBondContact O-CD1 3.26Å; P230-Y232 PolarHBondContact O-N 3.4Å; P230-I242 HydrophobicContact CB-CG2 4.05Å; P230-I242 HydrophobicContact CG-CG2 4.13Å
231	E	91.9	Very high	93.1	Very high	112 Å²	112	61.1 Å²	61.1	52%	0.523	31%	0.305	S	S	.	.	P	Polyproline II helix	trans	-70.5	125.1	166.4	-64.4	179.9	-159.6	0	0	109.2	G243 K244	E231-G243 PolarHBondContact O-N 3Å; E231-K244 WeakPolarHBondContact OE1-CE 3.48Å; E231-K244 IonicContact OE1-NZ 3.59Å; E231-K244 WeakPolarHBondContact OE2-CE 3.43Å; E231-K244 WeakPolarHBondContact OE2-CG 3.49Å
232	Y	93.2	Very high	92.9	Very high	18 Å²	18	60 Å²	60	7%	0.071	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	156.9	178.1	64.8	-94	0	0	0	111.3	Q175 I181 V229 P230 F234 V240 L241	Q175-Y232 HydrophobicContact CB-CE2 4.12Å; Q175-Y232 HydrophobicContact CG-CE2 3.98Å; Q175-Y232 PolarHBondContact N-OH 3.01Å; Q175-Y232 PolarHBondContact NE2-O 3.3Å; I181-Y232 HydrophobicContact CB-CD1 4.05Å; I181-Y232 HydrophobicContact CB-CE1 4.01Å; I181-Y232 HydrophobicContact CD1-CD1 4.17Å; I181-Y232 HydrophobicContact CD1-CD2 3.8Å; I181-Y232 HydrophobicContact CD1-CE1 4.42Å; I181-Y232 HydrophobicContact CD1-CE2 4.04Å; I181-Y232 HydrophobicContact CD1-CG 3.89Å; I181-Y232 HydrophobicContact CG2-CD1 4.27Å; V229-Y232 HydrophobicContact CG1-CD1 4.42Å; V229-Y232 HydrophobicContact CG1-CE1 3.72Å; P230-Y232 WeakPolarHBondContact O-CD1 3.26Å; P230-Y232 PolarHBondContact O-N 3.4Å; Y232-F234 HydrophobicContact CD2-CE2 4.2Å; Y232-F234 HydrophobicContact CD2-CZ 4.42Å; Y232-F234 AromaticContact CE2-CE2 3.71Å; Y232-F234 HydrophobicContact CE2-CE2 3.71Å; Y232-F234 AromaticContact CE2-CZ 3.98Å; Y232-F234 HydrophobicContact CE2-CZ 3.98Å; Y232-V240 HydrophobicContact CD2-CG2 3.92Å; Y232-V240 HydrophobicContact CG-CG2 4.36Å; Y232-L241 CarbonylContact C-O 3.49Å; Y232-L241 WeakPolarHBondContact CA-O 3.47Å; Y232-L241 VanDerWaalsContact CB-O 3.24Å; Y232-L241 WeakPolarHBondContact CB-O 3.45Å
233	S	92.2	Very high	92.4	Very high	48 Å²	48	57.2 Å²	57.2	34%	0.336	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	145.9	173.6	61.3	0	0	0	0	110.6	L241	S233-L241 PolarHBondContact N-O 3.31Å; S233-L241 PolarHBondContact O-N 2.86Å
234	F	92.3	Very high	91.2	Very high	42 Å²	42	63.8 Å²	63.8	18%	0.184	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	118.8	172.9	-64.4	-82.7	0	0	0	108.9	L125 Q175 K176 W179 Y232 V240	L125-F234 HydrophobicContact CD1-CD1 4.18Å; L125-F234 HydrophobicContact CD1-CE1 4.07Å; Q175-F234 HydrophobicContact CB-CE2 4.05Å; K176-F234 HydrophobicContact CB-CE2 4.15Å; K176-F234 HydrophobicContact CB-CZ 4.11Å; K176-F234 HydrophobicContact CD-CD1 4.38Å; K176-F234 HydrophobicContact CD-CD2 4.09Å; K176-F234 HydrophobicContact CD-CE1 4.15Å; K176-F234 HydrophobicContact CD-CE2 3.83Å; K176-F234 HydrophobicContact CD-CG 4.36Å; K176-F234 HydrophobicContact CD-CZ 3.88Å; K176-F234 HydrophobicContact CG-CD2 4.33Å; K176-F234 HydrophobicContact CG-CE2 3.8Å; K176-F234 HydrophobicContact CG-CZ 4.11Å; W179-F234 HydrophobicContact CB-CE1 4.4Å; W179-F234 HydrophobicContact CB-CZ 4.02Å; W179-F234 AromaticContact CD1-CE1 3.96Å; W179-F234 HydrophobicContact CG-CE1 4.23Å; W179-F234 HydrophobicContact CG-CZ 4.28Å; Y232-F234 HydrophobicContact CD2-CE2 4.2Å; Y232-F234 HydrophobicContact CD2-CZ 4.42Å; Y232-F234 AromaticContact CE2-CE2 3.71Å; Y232-F234 HydrophobicContact CE2-CE2 3.71Å; Y232-F234 AromaticContact CE2-CZ 3.98Å; Y232-F234 HydrophobicContact CE2-CZ 3.98Å; F234-V240 HydrophobicContact CD1-CB 4.08Å; F234-V240 HydrophobicContact CD1-CG2 4.07Å; F234-V240 HydrophobicContact CE1-CB 4.16Å; F234-V240 HydrophobicContact CE1-CG2 4.05Å
235	K	88.4	Confident	89.3	Confident	111 Å²	111	63.5 Å²	63.5	48%	0.483	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	-47	176.1	-178.4	-177.7	-175.2	178.1	0	110.5	E122 T239 L241	E122-K235 IonicContact OE1-NZ 3.95Å; E122-K235 PolarHBondContact OE1-NZ 3.34Å; E122-K235 IonicContact OE2-NZ 3.48Å; K235-T239 PolarHBondContact N-O 2.67Å; K235-L241 HydrophobicContact CB-CD1 4.03Å; K235-L241 HydrophobicContact CB-CG 4.05Å; K235-L241 HydrophobicContact CD-CD1 4.3Å; K235-L241 HydrophobicContact CD-CD2 4.34Å; K235-L241 HydrophobicContact CG-CD1 4.48Å
236	D	88.7	Confident	86.9	Confident	96 Å²	96	67.8 Å²	67.8	51%	0.513	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	170.9	176.6	-58.6	-58.6	0	0	0	108.5	R238 T239	D236-R238 PolarHBondContact O-N 3.3Å; D236-T239 PolarHBondContact N-O 2.61Å; D236-T239 PolarHBondContact O-N 3.35Å
237	D	87.1	Confident	86.4	Confident	133 Å²	133	70.8 Å²	70.8	71%	0.711	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.4	-15.1	177	-74	-33.4	0	0	0	114.3	K176	K176-D237 IonicContact NZ-OD1 2.79Å; K176-D237 PolarHBondContact NZ-OD1 2.97Å
238	R	88.9	Confident	85.9	Confident	160 Å²	160	74.5 Å²	74.5	60%	0.604	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.4	-5.9	-179.1	-59.2	-177	-173.8	179.5	1.9	114.2	N124 L125 D126 D236	N124-R238 WeakPolarHBondContact CA-O 3.41Å; N124-R238 PolarHBondContact OD1-O 3.07Å; L125-R238 WeakPolarHBondContact CB-O 3.48Å; L125-R238 WeakPolarHBondContact CG-O 3.4Å; L125-R238 PolarHBondContact N-O 3.06Å; D126-R238 WeakPolarHBondContact OD2-CD 3.27Å; D236-R238 PolarHBondContact O-N 3.3Å
239	T	91.9	Very high	85.4	Confident	25 Å²	25	71.9 Å²	71.9	15%	0.153	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	123.3	-172.2	-50.4	0	0	0	0	110.8	E122 I123 K235 D236	E122-T239 HydrophobicContact CB-CG2 4.18Å; I123-T239 WeakPolarHBondContact O-CA 3.29Å; K235-T239 PolarHBondContact N-O 2.67Å; D236-T239 PolarHBondContact N-O 2.61Å; D236-T239 PolarHBondContact O-N 3.35Å
240	V	93.1	Very high	84.8	Confident	0 Å²	0	73.4 Å²	73.4	0%	0	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	134.9	173.1	68.6	0	0	0	0	110.7	I123 L125 I181 Y232 F234	I123-V240 HydrophobicContact CB-CG1 3.86Å; I123-V240 PolarHBondContact N-O 2.88Å; I123-V240 PolarHBondContact O-N 3.34Å; L125-V240 HydrophobicContact CD2-CB 4.2Å; L125-V240 HydrophobicContact CD2-CG1 3.76Å; L125-V240 HydrophobicContact CG-CG1 4.45Å; I181-V240 HydrophobicContact CD1-CB 4.31Å; I181-V240 HydrophobicContact CD1-CG1 4.05Å; I181-V240 HydrophobicContact CD1-CG2 3.57Å; Y232-V240 HydrophobicContact CD2-CG2 3.92Å; Y232-V240 HydrophobicContact CG-CG2 4.36Å; F234-V240 HydrophobicContact CD1-CB 4.08Å; F234-V240 HydrophobicContact CD1-CG2 4.07Å; F234-V240 HydrophobicContact CE1-CB 4.16Å; F234-V240 HydrophobicContact CE1-CG2 4.05Å
241	L	92.3	Very high	84.3	Confident	21 Å²	21	77.6 Å²	77.6	11%	0.11	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	123.4	173.4	-58.8	179	0	0	0	108.5	V120 E122 Y232 S233 K235	V120-L241 HydrophobicContact CG1-CB 4.14Å; V120-L241 HydrophobicContact CG1-CD2 4.29Å; E122-L241 HydrophobicContact CB-CD2 3.9Å; E122-L241 HydrophobicContact CG-CD2 3.38Å; E122-L241 WeakPolarHBondContact OE1-CD2 3.43Å; Y232-L241 CarbonylContact C-O 3.49Å; Y232-L241 WeakPolarHBondContact CA-O 3.47Å; Y232-L241 VanDerWaalsContact CB-O 3.24Å; Y232-L241 WeakPolarHBondContact CB-O 3.45Å; S233-L241 PolarHBondContact N-O 3.31Å; S233-L241 PolarHBondContact O-N 2.86Å; K235-L241 HydrophobicContact CB-CD1 4.03Å; K235-L241 HydrophobicContact CB-CG 4.05Å; K235-L241 HydrophobicContact CD-CD1 4.3Å; K235-L241 HydrophobicContact CD-CD2 4.34Å; K235-L241 HydrophobicContact CG-CD1 4.48Å
242	I	91	Very high	83.8	Confident	0 Å²	0	75.3 Å²	75.3	0%	0	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	122.7	176	-61.9	169.4	0	0	0	108.7	V120 V121 I123 W138 V143 V145 I181 P230	V120-I242 VanDerWaalsContact CA-O 3.31Å; V120-I242 WeakPolarHBondContact CA-O 3.34Å; V121-I242 PolarHBondContact N-O 3.04Å; V121-I242 PolarHBondContact O-N 3.18Å; I123-I242 HydrophobicContact CD1-CD1 3.38Å; I123-I242 HydrophobicContact CD1-CG1 4.5Å; I123-I242 HydrophobicContact CG1-CD1 4.27Å; W138-I242 HydrophobicContact CD2-CG2 3.92Å; W138-I242 HydrophobicContact CE3-CG2 4.18Å; W138-I242 HydrophobicContact CG-CG2 4.27Å; W138-I242 HydrophobicContact CZ2-CG2 4.38Å; W138-I242 PolarHBondContact NE1-O 3.04Å; V143-I242 HydrophobicContact CG1-CD1 3.96Å; V145-I242 HydrophobicContact CG2-CD1 4.46Å; I181-I242 HydrophobicContact CG2-CD1 3.88Å; I181-I242 HydrophobicContact CG2-CG1 4.35Å; P230-I242 HydrophobicContact CB-CG2 4.05Å; P230-I242 HydrophobicContact CG-CG2 4.13Å
243	G	85.9	Confident	83.1	Confident	5 Å²	5	79.4 Å²	79.4	5%	0.052	40%	0.396	C	S	.	.	S	Bend	trans	118.9	163.6	-173.8	0	0	0	0	0	112.8	E231 A245	E231-G243 PolarHBondContact O-N 3Å; G243-A245 PolarHBondContact O-N 3.18Å; G243-A245 VanDerWaalsContact O-N 3.1Å
244	K	70.2	Confident	82.4	Confident	138 Å²	138	81.8 Å²	81.8	60%	0.6	40%	0.4	S	S	*	.			trans	-65.8	109	171.4	-74.3	-177	178.7	-176.6	0	108.7	V120 E231 E246	V120-K244 VanDerWaalsContact CG2-O 3.3Å; V120-K244 WeakPolarHBondContact CG2-O 3.25Å; E231-K244 WeakPolarHBondContact OE1-CE 3.48Å; E231-K244 IonicContact OE1-NZ 3.59Å; E231-K244 WeakPolarHBondContact OE2-CE 3.43Å; E231-K244 WeakPolarHBondContact OE2-CG 3.49Å; K244-E246 PolarHBondContact O-N 3.19Å
245	A	55	Low	81.6	Confident	67 Å²	67	85.1 Å²	85.1	55%	0.554	42%	0.418	S	S	*	.			trans	-69.5	109.1	157.3	0	0	0	0	0	106.1	G243	G243-A245 PolarHBondContact O-N 3.18Å; G243-A245 VanDerWaalsContact O-N 3.1Å
246	E	47	Very low	81	Confident	265 Å²	265	82.7 Å²	82.7	100%	1.238	41%	0.412	S	S	*	.			trans	-69.3	0	168.6	-143	169.1	-153.7	0	0	110.2	K244	K244-E246 PolarHBondContact O-N 3.19Å

Retrieved 246 of 246 residues in 95.4 ms (Link to these results)

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