A0A077ZCL0_TRITR Loading...

Histone binding protein RBBP4

AlphaFold DB , UniProt , Accession A0A077ZCL0, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 332 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	23.4	Very low	28.3	Very low	192 Å²	192	96 Å²	96	95%	0.946	54%	0.544	S	S	*	.				0	99.5	0	-174.8	-178.7	-79.4	0	0	106.1	L3 L49	M1-L3 PolarHBondContact O-N 3.36Å; M1-L3 HydrophobicContact SD-CD2 4.5Å; M1-L49 HydrophobicContact CE-CD2 4.02Å; M1-L49 HydrophobicContact CG-CD2 3.81Å; M1-L49 HydrophobicContact SD-CD2 3.9Å
2	Q	28.4	Very low	27.8	Very low	88 Å²	88	102.4 Å²	102.4	41%	0.411	58%	0.575	S	S	.	*			trans	-84	108.4	173.8	-174.2	170.1	-12	0	0	106.3	S4	Q2-S4 PolarHBondContact O-N 3.26Å
3	L	29.6	Very low	27.8	Very low	82 Å²	82	101.8 Å²	101.8	43%	0.429	59%	0.592	S	S	.	*			trans	-79.2	99.5	171	-70.9	168.4	0	0	0	106.5	M1 L5 A47	M1-L3 PolarHBondContact O-N 3.36Å; M1-L3 HydrophobicContact SD-CD2 4.5Å; L3-L5 VanDerWaalsContact C-N 3.3Å; L3-L5 HydrophobicContact CB-CG 4.4Å; L3-L5 PolarHBondContact O-N 3.49Å; L3-A47 HydrophobicContact CD2-CB 3.58Å
4	S	33.5	Very low	27.6	Very low	22 Å²	22	108.5 Å²	108.5	15%	0.154	61%	0.614	C	S	.	*			trans	-75.2	90.5	167.7	-154.6	0	0	0	0	107.2	Q2 Y113	Q2-S4 PolarHBondContact O-N 3.26Å; S4-Y113 WeakPolarHBondContact OG-CD1 3.17Å; S4-Y113 WeakPolarHBondContact OG-CE1 3.5Å
5	L	30.5	Very low	27.4	Very low	89 Å²	89	111 Å²	111	47%	0.466	63%	0.632	S	S	.	*			trans	-78	120.3	175.2	-67.8	167.9	0	0	0	108.2	L3 F65 Y113	L3-L5 VanDerWaalsContact C-N 3.3Å; L3-L5 HydrophobicContact CB-CG 4.4Å; L3-L5 PolarHBondContact O-N 3.49Å; L5-F65 HydrophobicContact CD2-CZ 3.68Å; L5-Y113 PolarHBondContact O-OH 3.05Å
6	G	27.5	Very low	27.2	Very low	41 Å²	41	107.9 Å²	107.9	42%	0.423	63%	0.633	S	S	.	*			trans	-82.3	129.5	160.7	0	0	0	0	0	108.6
7	Q	30.3	Very low	27	Very low	130 Å²	130	111.3 Å²	111.3	61%	0.607	65%	0.648	S	S	*	*			trans	-109.4	133.9	165.4	-90.2	-165	-8.4	0	0	109.9	H312	Q7-H312 PolarHBondContact NE2-CE1 2.83Å; Q7-H312 PolarHBondContact NE2-NE2 3.28Å; Q7-H312 PolarHBondContact OE1-CE1 3.17Å
8	E	28.5	Very low	27.2	Very low	82 Å²	82	112.7 Å²	112.7	38%	0.383	66%	0.657	S	S	.	*			trans	-101	129.7	158.1	-74.3	-166.4	-179.1	0	0	109.8	V10 A38 P39	E8-V10 PolarHBondContact O-N 3.3Å; E8-A38 WeakPolarHBondContact OE2-CA 3.44Å; E8-P39 WeakPolarHBondContact OE1-CD 3.23Å; E8-P39 WeakPolarHBondContact OE2-CD 3.27Å
9	S	24.8	Very low	27.2	Very low	120 Å²	120	112.5 Å²	112.5	84%	0.839	66%	0.66	S	S	*	*			trans	-76.2	109.6	165.2	57.8	0	0	0	0	109.6
10	V	30.7	Very low	27.5	Very low	96 Å²	96	113.2 Å²	113.2	58%	0.582	67%	0.668	S	S	*	*			trans	-95.1	125.4	169.4	-175.5	0	0	0	0	108.6	E8	E8-V10 PolarHBondContact O-N 3.3Å
11	P	24.3	Very low	27.6	Very low	114 Å²	114	113.8 Å²	113.8	74%	0.74	67%	0.673	S	S	*	*			trans	-74.5	143.1	174.2	28.1	-31	0	0	0	111.8	A13	P11-A13 PolarHBondContact O-N 2.78Å
12	D	22.1	Very low	27.8	Very low	173 Å²	173	109.7 Å²	109.7	93%	0.925	67%	0.67	S	S	*	*			trans	-28.3	106.8	-178.2	-67.7	-45.7	0	0	0	115.4
13	A	28.4	Very low	27.7	Very low	95 Å²	95	110.8 Å²	110.8	79%	0.785	69%	0.685	S	S	*	*			trans	-103	121.9	167.1	0	0	0	0	0	110.1	P11	P11-A13 PolarHBondContact O-N 2.78Å
14	Q	24	Very low	27.7	Very low	195 Å²	195	116.4 Å²	116.4	91%	0.911	71%	0.706	S	S	*	*			trans	-61.3	139.5	-174.1	-67	-169.9	-12.1	0	0	113.7	G16	Q14-G16 PolarHBondContact O-N 3.2Å
15	V	25	Very low	27.6	Very low	146 Å²	146	119.4 Å²	119.4	89%	0.885	74%	0.74	S	S	*	*			trans	-59.9	112	179.3	-179.2	0	0	0	0	111.5
16	G	23.8	Very low	27.9	Very low	62 Å²	62	120 Å²	120	64%	0.639	75%	0.751	S	S	*	*			trans	-117.4	120.5	167.8	0	0	0	0	0	111	Q14 V18	Q14-G16 PolarHBondContact O-N 3.2Å; G16-V18 PolarHBondContact O-N 3.09Å
17	N	23.6	Very low	28.5	Very low	165 Å²	165	121 Å²	121	88%	0.882	75%	0.747	S	S	*	*			trans	-61.5	125.4	176.8	-79.5	-36.4	0	0	0	112.5
18	V	32	Very low	28.8	Very low	136 Å²	136	118 Å²	118	82%	0.824	75%	0.751	S	S	*	*			trans	-140.2	141.3	169.3	-178.7	0	0	0	0	109.9	G16	G16-V18 PolarHBondContact O-N 3.09Å
19	P	26.9	Very low	29.3	Very low	109 Å²	109	118.6 Å²	118.6	71%	0.708	76%	0.757	S	S	*	*			trans	-91.8	176	-156.4	38.4	-35.3	0	0	0	114.6	T21	P19-T21 PolarHBondContact O-N 3.16Å
20	P	32.7	Very low	30.2	Very low	126 Å²	126	114.3 Å²	114.3	82%	0.818	72%	0.724	S	S	*	*			trans	-87.8	111.2	-164.5	33.8	-29.3	0	0	0	111.7
21	T	29.5	Very low	30.9	Very low	126 Å²	126	111 Å²	111	77%	0.773	71%	0.71	S	S	*	*			trans	-139.6	104.1	149.8	51.4	0	0	0	0	106.5	P19 P23	P19-T21 PolarHBondContact O-N 3.16Å; T21-P23 WeakPolarHBondContact O-CD 3.32Å
22	A	27.7	Very low	32.2	Very low	106 Å²	106	106.7 Å²	106.7	88%	0.876	68%	0.681	S	S	*	*			trans	-75.8	110.4	169.2	0	0	0	0	0	108.1
23	P	27.3	Very low	33.8	Very low	112 Å²	112	98.6 Å²	98.6	73%	0.727	64%	0.638	S	S	*	*			trans	-84.3	151.3	165.7	11.7	10	0	0	0	108	T21 G25	T21-P23 WeakPolarHBondContact O-CD 3.32Å; P23-G25 PolarHBondContact O-N 2.88Å
24	K	28.8	Very low	34.9	Very low	200 Å²	200	95.9 Å²	95.9	87%	0.87	61%	0.61	S	S	*	*			trans	-38.9	116.2	169	-67	170.8	174.7	178.1	0	109.7	S26	K24-S26 PolarHBondContact O-N 3.02Å
25	G	31.2	Very low	36.1	Very low	85 Å²	85	89 Å²	89	88%	0.876	58%	0.582	S	S	*	*			trans	-67.3	78.1	171.7	0	0	0	0	0	109.6	P23	P23-G25 PolarHBondContact O-N 2.88Å
26	S	36.6	Very low	36.9	Very low	100 Å²	100	89.1 Å²	89.1	70%	0.699	57%	0.57	S	S	*	*			trans	-79.2	126.2	156.2	61	0	0	0	0	106.4	K24 G28	K24-S26 PolarHBondContact O-N 3.02Å; S26-G28 PolarHBondContact O-N 2.78Å
27	L	40.3	Very low	37.8	Very low	64 Å²	64	93.6 Å²	93.6	34%	0.335	57%	0.568	S	S	.	*			trans	-63.8	45.6	174.1	-155.2	80.6	0	0	0	111.8	D29 L30 D97	L27-D29 VanDerWaalsContact C-N 3.3Å; L27-L30 HydrophobicContact CD2-CD1 3.49Å; L27-L30 VanDerWaalsContact CD2-CD1 3.49Å; L27-L30 HydrophobicContact CD2-CG 4.25Å; L27-L30 HydrophobicContact CG-CD1 3.76Å; L27-L30 HydrophobicContact CG-CG 3.95Å; L27-D97 HydrophobicContact CD2-CB 4.01Å
28	G	35.9	Very low	38.7	Very low	67 Å²	67	89.1 Å²	89.1	69%	0.691	55%	0.554	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.7	10	-176.1	0	0	0	0	0	113.6	S26	S26-G28 PolarHBondContact O-N 2.78Å
29	D	40.4	Very low	39.5	Very low	94 Å²	94	85.5 Å²	85.5	50%	0.503	53%	0.533	S	S	.	.	T	Hydrogen-bonded Turn	trans	-129.8	26.8	-178.6	-144.1	30.2	0	0	0	113.6	L27 G31 R40	L27-D29 VanDerWaalsContact C-N 3.3Å; D29-G31 PolarHBondContact O-N 3.46Å; D29-R40 IonicContact OD1-CZ 3.58Å; D29-R40 IonicContact OD1-NH1 2.62Å; D29-R40 PolarHBondContact OD1-NH1 3.14Å; D29-R40 WeakPolarHBondContact OD2-CD 3.34Å; D29-R40 IonicContact OD2-CZ 3.87Å; D29-R40 IonicContact OD2-NE 3.97Å; D29-R40 IonicContact OD2-NH1 2.98Å; D29-R40 PolarHBondContact OD2-NH1 3.14Å
30	L	42.6	Very low	40.9	Very low	30 Å²	30	89.3 Å²	89.3	16%	0.157	53%	0.533	C	S	.	.			trans	-68.6	93.3	158.5	-63.7	174.7	0	0	0	106.3	L27 L44 I99	L27-L30 HydrophobicContact CD2-CD1 3.49Å; L27-L30 VanDerWaalsContact CD2-CD1 3.49Å; L27-L30 HydrophobicContact CD2-CG 4.25Å; L27-L30 HydrophobicContact CG-CD1 3.76Å; L27-L30 HydrophobicContact CG-CG 3.95Å; L30-L44 HydrophobicContact CD2-CD2 3.56Å; L30-I99 HydrophobicContact CD1-CB 4.26Å; L30-I99 HydrophobicContact CD1-CD1 3.87Å; L30-I99 HydrophobicContact CD1-CG1 3.7Å; L30-I99 HydrophobicContact CD1-CG2 3.78Å; L30-I99 HydrophobicContact CD2-CD1 4.19Å
31	G	46.5	Very low	42.5	Very low	27 Å²	27	85.4 Å²	85.4	28%	0.278	51%	0.505	S	S	.	.			trans	-53.9	177.1	162.3	0	0	0	0	0	110.9	D29	D29-G31 PolarHBondContact O-N 3.46Å
32	P	50.1	Low	44.3	Very low	22 Å²	22	83.4 Å²	83.4	14%	0.143	50%	0.495	C	S	.	.			trans	-47.5	151.3	-178.8	21	-33.6	0	0	0	111.8	D34 R46	P32-D34 HydrophobicContact CB-CB 3.88Å; P32-D34 HydrophobicContact CG-CB 4.04Å; P32-D34 PolarHBondContact O-N 3.06Å; P32-R46 PolarHBondContact O-NH2 3.15Å
33	L	56.6	Low	46.5	Very low	4 Å²	4	78.4 Å²	78.4	2%	0.021	45%	0.453	C	S	.	.	S	Bend	trans	-60.5	-14.7	174.5	-83.7	170.4	0	0	0	112	V35 R46 I62 L100 V135 L137 L142	L33-V35 WeakPolarHBondContact O-CG2 3.31Å; L33-V35 PolarHBondContact O-N 3.17Å; L33-R46 PolarHBondContact O-NH1 2.62Å; L33-I62 HydrophobicContact CD1-CD1 3.98Å; L33-I62 HydrophobicContact CD2-CD1 4.22Å; L33-I62 HydrophobicContact CD2-CG2 4.39Å; L33-L100 HydrophobicContact CD1-CD2 3.55Å; L33-V135 WeakPolarHBondContact CB-O 3.37Å; L33-V135 HydrophobicContact CD1-CB 4.15Å; L33-V135 WeakPolarHBondContact CD1-O 3.19Å; L33-L137 HydrophobicContact CD1-CB 4.42Å; L33-L137 HydrophobicContact CD1-CD1 3.89Å; L33-L137 HydrophobicContact CD1-CG 4.19Å; L33-L142 HydrophobicContact CB-CD1 4.26Å; L33-L142 HydrophobicContact CD1-CD1 4.45Å; L33-L142 HydrophobicContact CD1-CD2 3.66Å; L33-L142 HydrophobicContact CG-CD1 3.89Å; L33-L142 HydrophobicContact CG-CD2 3.76Å; L33-L142 HydrophobicContact CG-CG 4.48Å; L33-L142 VanDerWaalsContact N-CD1 3.33Å
34	D	50.6	Low	48.9	Very low	38 Å²	38	75.1 Å²	75.1	20%	0.203	43%	0.429	C	S	.	.			trans	-40	97.8	168.6	-173.4	4.3	0	0	0	112.7	P32 K36 R37	P32-D34 HydrophobicContact CB-CB 3.88Å; P32-D34 HydrophobicContact CG-CB 4.04Å; P32-D34 PolarHBondContact O-N 3.06Å; D34-K36 PolarHBondContact O-N 3.38Å; D34-K36 WeakPolarHBondContact OD1-CB 3.46Å; D34-K36 PolarHBondContact OD1-N 3.11Å; D34-K36 VanDerWaalsContact OD1-N 3.09Å; D34-R37 PolarHBondContact O-N 3.07Å; D34-R37 IonicContact OD2-NE 3.28Å
35	V	49.1	Very low	51.4	Low	51 Å²	51	67.5 Å²	67.5	31%	0.309	40%	0.397	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.2	-12	-178.9	-176.3	0	0	0	0	111.5	L33 R37 P118 T119	L33-V35 WeakPolarHBondContact O-CG2 3.31Å; L33-V35 PolarHBondContact O-N 3.17Å; V35-R37 PolarHBondContact O-N 2.99Å; V35-P118 HydrophobicContact CB-CB 4.12Å; V35-P118 HydrophobicContact CB-CG 4.31Å; V35-P118 HydrophobicContact CG1-CB 3.97Å; V35-P118 HydrophobicContact CG1-CG 3.9Å; V35-P118 HydrophobicContact CG2-CB 3.96Å; V35-T119 HydrophobicContact CG2-CG2 4.34Å
36	K	42.1	Very low	54	Low	148 Å²	148	66.6 Å²	66.6	64%	0.643	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.6	-11.6	175.3	-64.2	-177.9	-177.9	169.2	0	112.7	D34 E117	D34-K36 PolarHBondContact O-N 3.38Å; D34-K36 WeakPolarHBondContact OD1-CB 3.46Å; D34-K36 PolarHBondContact OD1-N 3.11Å; D34-K36 VanDerWaalsContact OD1-N 3.09Å; K36-E117 WeakPolarHBondContact CE-OE1 3.16Å; K36-E117 WeakPolarHBondContact CE-OE2 3.48Å; K36-E117 IonicContact NZ-OE1 2.88Å; K36-E117 IonicContact NZ-OE2 3.92Å; K36-E117 PolarHBondContact NZ-OE2 2.9Å
37	R	43.3	Very low	56.5	Low	155 Å²	155	61.9 Å²	61.9	59%	0.585	33%	0.334	S	S	*	.	S	Bend	trans	-91.4	119.7	168.7	-72.4	-176.2	179.8	-175.7	0.9	108.8	D34 V35	D34-R37 PolarHBondContact O-N 3.07Å; D34-R37 IonicContact OD2-NE 3.28Å; V35-R37 PolarHBondContact O-N 2.99Å
38	A	43.1	Very low	58.9	Low	71 Å²	71	59.6 Å²	59.6	59%	0.587	32%	0.322	S	S	*	.			trans	-46	129.3	172.5	0	0	0	0	0	110.4	E8 R40	E8-A38 WeakPolarHBondContact OE2-CA 3.44Å; A38-R40 PolarHBondContact O-N 3.38Å
39	P	48.1	Very low	61.5	Low	60 Å²	60	57.8 Å²	57.8	39%	0.39	30%	0.297	S	S	.	.			trans	-53	132.1	172.6	-20.4	28.7	0	0	0	108.1	E8 D41	E8-P39 WeakPolarHBondContact OE1-CD 3.23Å; E8-P39 WeakPolarHBondContact OE2-CD 3.27Å; P39-D41 WeakPolarHBondContact CB-O 3.44Å; P39-D41 PolarHBondContact O-N 2.77Å; P39-D41 VanDerWaalsContact O-N 3.09Å
40	R	56.7	Low	63.8	Low	189 Å²	189	54.4 Å²	54.4	71%	0.713	28%	0.284	S	S	*	.	S	Bend	trans	-59.5	-20	171.5	-69.6	-176.7	177.7	179.6	8.5	112.1	D29 A38	D29-R40 IonicContact OD1-CZ 3.58Å; D29-R40 IonicContact OD1-NH1 2.62Å; D29-R40 PolarHBondContact OD1-NH1 3.14Å; D29-R40 WeakPolarHBondContact OD2-CD 3.34Å; D29-R40 IonicContact OD2-CZ 3.87Å; D29-R40 IonicContact OD2-NE 3.97Å; D29-R40 IonicContact OD2-NH1 2.98Å; D29-R40 PolarHBondContact OD2-NH1 3.14Å; A38-R40 PolarHBondContact O-N 3.38Å
41	D	65.7	Low	65.5	Low	44 Å²	44	54.9 Å²	54.9	24%	0.235	29%	0.289	C	S	.	.			trans	-129.2	112.4	-178.3	179.9	9.1	0	0	0	110.9	P39 G43 L44 R66	P39-D41 WeakPolarHBondContact CB-O 3.44Å; P39-D41 PolarHBondContact O-N 2.77Å; P39-D41 VanDerWaalsContact O-N 3.09Å; D41-G43 PolarHBondContact O-N 2.89Å; D41-G43 VanDerWaalsContact O-N 3.15Å; D41-G43 PolarHBondContact OD1-N 3.06Å; D41-L44 HydrophobicContact CB-CB 4.21Å; D41-L44 PolarHBondContact O-N 3.09Å; D41-R66 IonicContact OD1-NH2 3.42Å; D41-R66 IonicContact OD2-CZ 3.79Å; D41-R66 VanDerWaalsContact OD2-CZ 3.28Å; D41-R66 IonicContact OD2-NE 3.06Å; D41-R66 PolarHBondContact OD2-NE 3.08Å; D41-R66 VanDerWaalsContact OD2-NE 3.12Å; D41-R66 IonicContact OD2-NH2 2.86Å; D41-R66 PolarHBondContact OD2-NH2 3.11Å
42	P	68.5	Low	66.9	Low	84 Å²	84	60.1 Å²	60.1	55%	0.545	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-13.6	-179.7	21.8	-26.9	0	0	0	113.9	M69	P42-M69 HydrophobicContact CB-CE 3.66Å; P42-M69 HydrophobicContact CG-CE 3.7Å; P42-M69 WeakPolarHBondContact O-CE 3.41Å
43	G	71.9	Confident	68.1	Low	1 Å²	1	62 Å²	62	1%	0.01	31%	0.312	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.5	-11.2	178.8	0	0	0	0	0	113.1	D41 H45 R66 A67	D41-G43 PolarHBondContact O-N 2.89Å; D41-G43 VanDerWaalsContact O-N 3.15Å; D41-G43 PolarHBondContact OD1-N 3.06Å; G43-H45 PolarHBondContact O-CD2 2.98Å; G43-H45 VanDerWaalsContact O-CD2 3.31Å; G43-R66 CarbonylContact O-C 3.44Å; G43-R66 WeakPolarHBondContact O-CA 2.85Å; G43-R66 WeakPolarHBondContact O-CG 3.49Å; G43-A67 PolarHBondContact O-N 3.01Å
44	L	77.9	Confident	69.2	Low	43 Å²	43	65.3 Å²	65.3	23%	0.225	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	118.4	-175.5	-177.9	69.4	0	0	0	110.5	L30 D41	L30-L44 HydrophobicContact CD2-CD2 3.56Å; D41-L44 HydrophobicContact CB-CB 4.21Å; D41-L44 PolarHBondContact O-N 3.09Å
45	H	82.1	Confident	70.5	Confident	41 Å²	41	71.2 Å²	71.2	19%	0.19	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	158.4	174	-63	-89.8	0	0	0	110.5	G43 G64 F65 A67	G43-H45 PolarHBondContact O-CD2 2.98Å; G43-H45 VanDerWaalsContact O-CD2 3.31Å; H45-G64 CarbonylContact O-C 3.59Å; H45-G64 WeakPolarHBondContact O-CA 3.39Å; H45-F65 HydrophobicContact CB-CD1 4.48Å; H45-F65 HydrophobicContact CB-CD2 4.22Å; H45-F65 HydrophobicContact CB-CE1 3.95Å; H45-F65 HydrophobicContact CB-CE2 3.66Å; H45-F65 HydrophobicContact CB-CZ 3.5Å; H45-F65 PolarHBondContact N-O 3.04Å; H45-F65 PolarHBondContact O-N 3.35Å; H45-A67 WeakPolarHBondContact CD2-CB 3.31Å; H45-A67 VanDerWaalsContact NE2-CB 3.33Å; H45-A67 WeakPolarHBondContact NE2-CB 3.5Å
46	R	86.1	Confident	72.1	Confident	65 Å²	65	74.1 Å²	74.1	25%	0.245	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	150.8	173.4	-62.7	176.9	-176.3	161.1	-3.1	110	P32 L33 I62 I63 I99	P32-R46 PolarHBondContact O-NH2 3.15Å; L33-R46 PolarHBondContact O-NH1 2.62Å; R46-I62 HydrophobicContact CB-CG2 4.42Å; R46-I63 CarbonylContact C-O 3.49Å; R46-I63 WeakPolarHBondContact CA-O 3.41Å; R46-I99 HydrophobicContact CG-CD1 4.12Å
47	A	87.9	Confident	74.4	Confident	1 Å²	1	74.8 Å²	74.8	1%	0.008	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	148	170.1	0	0	0	0	0	111.1	L3 I62 I63 F65	L3-A47 HydrophobicContact CD2-CB 3.58Å; A47-I62 WeakPolarHBondContact O-CA 3.33Å; A47-I63 HydrophobicContact CB-CD1 4.16Å; A47-I63 HydrophobicContact CB-CG1 3.83Å; A47-I63 PolarHBondContact N-O 3.36Å; A47-I63 PolarHBondContact O-N 3.03Å; A47-F65 HydrophobicContact CB-CE1 3.89Å
48	L	91.6	Very high	76.7	Confident	16 Å²	16	69.3 Å²	69.3	8%	0.084	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	129.6	174.9	-58.6	178.7	0	0	0	109.4	I62 I111 I121	L48-I62 HydrophobicContact CD2-CD1 4.29Å; L48-I62 HydrophobicContact CD2-CG1 3.81Å; L48-I62 HydrophobicContact CD2-CG2 4.48Å; L48-I111 HydrophobicContact CB-CD1 3.72Å; L48-I111 HydrophobicContact CB-CG1 3.88Å; L48-I111 HydrophobicContact CB-CG2 4.3Å; L48-I111 HydrophobicContact CD1-CD1 4.28Å; L48-I111 HydrophobicContact CD1-CG1 3.96Å; L48-I111 HydrophobicContact CG-CD1 4.47Å; L48-I121 HydrophobicContact CD1-CB 4.5Å; L48-I121 HydrophobicContact CD1-CD1 3.74Å; L48-I121 HydrophobicContact CD1-CG1 3.82Å; L48-I121 HydrophobicContact CD1-CG2 3.91Å; L48-I121 HydrophobicContact CD2-CD1 3.48Å; L48-I121 VanDerWaalsContact CD2-CD1 3.48Å; L48-I121 HydrophobicContact CD2-CG1 4.44Å; L48-I121 HydrophobicContact CG-CD1 4.26Å
49	L	90.8	Very high	79.1	Confident	29 Å²	29	66.9 Å²	66.9	15%	0.152	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	134.5	177.1	-54.5	177.6	0	0	0	109.7	M1 P51 V60 S61 I63	M1-L49 HydrophobicContact CE-CD2 4.02Å; M1-L49 HydrophobicContact CG-CD2 3.81Å; M1-L49 HydrophobicContact SD-CD2 3.9Å; L49-P51 VanDerWaalsContact C-CD 3.44Å; L49-P51 WeakPolarHBondContact O-CD 2.85Å; L49-V60 CarbonylContact O-C 3.53Å; L49-V60 WeakPolarHBondContact O-CA 3.29Å; L49-S61 WeakPolarHBondContact CB-OG 3.27Å; L49-S61 PolarHBondContact N-O 2.8Å; L49-S61 PolarHBondContact O-N 2.72Å; L49-I63 HydrophobicContact CD1-CD1 3.78Å; L49-I63 HydrophobicContact CD1-CG1 3.99Å; L49-I63 HydrophobicContact CD1-CG2 3.75Å; L49-I63 HydrophobicContact CG-CD1 4.34Å; L49-I63 HydrophobicContact CG-CG1 4.25Å; L49-I63 HydrophobicContact CG-CG2 4.49Å
50	G	88	Confident	81.3	Confident	23 Å²	23	64 Å²	64	24%	0.237	32%	0.323	C	S	.	.			trans	-114.4	75.5	165.8	0	0	0	0	0	109.2
51	P	78.1	Confident	83	Confident	40 Å²	40	55.3 Å²	55.3	26%	0.26	29%	0.291	S	S	.	.			trans	-66.8	149.5	-177	29.3	-34.6	0	0	0	110.9	L49 V53 F59	L49-P51 VanDerWaalsContact C-CD 3.44Å; L49-P51 WeakPolarHBondContact O-CD 2.85Å; P51-V53 HydrophobicContact CB-CG2 4.48Å; P51-F59 HydrophobicContact CB-CZ 4.47Å; P51-F59 HydrophobicContact CG-CD2 4Å; P51-F59 HydrophobicContact CG-CE1 4.09Å; P51-F59 HydrophobicContact CG-CE2 3.3Å; P51-F59 HydrophobicContact CG-CZ 3.36Å
52	Y	77.5	Confident	84.2	Confident	138 Å²	138	53.4 Å²	53.4	54%	0.541	28%	0.281	S	S	.	.			trans	-108.3	118.5	164.4	175.6	-103.7	0	0	0	108	R107	Y52-R107 HydrophobicContact CD2-CB 4.28Å; Y52-R107 HydrophobicContact CD2-CG 3.74Å; Y52-R107 HydrophobicContact CG-CG 4.2Å
53	V	75.2	Confident	85.2	Confident	61 Å²	61	49.9 Å²	49.9	37%	0.37	26%	0.257	S	S	.	.			trans	-121	127.1	175.6	-175.6	0	0	0	0	107.2	P51 D55 E56	P51-V53 HydrophobicContact CB-CG2 4.48Å; V53-D55 PolarHBondContact O-N 2.65Å; V53-E56 HydrophobicContact CB-CB 4.12Å; V53-E56 HydrophobicContact CB-CG 4.23Å; V53-E56 HydrophobicContact CG1-CB 4.28Å; V53-E56 HydrophobicContact CG1-CG 3.86Å; V53-E56 PolarHBondContact O-N 3.12Å
54	S	79	Confident	85.8	Confident	73 Å²	73	50 Å²	50	51%	0.51	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.6	137.1	174.6	-174.2	0	0	0	0	109.1	E56	S54-E56 PolarHBondContact O-N 3.33Å
55	D	78.5	Confident	86.1	Confident	163 Å²	163	49.5 Å²	49.5	87%	0.872	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.6	11.1	175	-47.5	-65.1	0	0	0	115.9	V53	V53-D55 PolarHBondContact O-N 2.65Å
56	E	83	Confident	86	Confident	111 Å²	111	53.5 Å²	53.5	52%	0.519	27%	0.267	S	S	.	.	S	Bend	trans	-111.4	153.4	168.6	-65	-172.4	172.7	0	0	111.1	V53 S54	V53-E56 HydrophobicContact CB-CB 4.12Å; V53-E56 HydrophobicContact CB-CG 4.23Å; V53-E56 HydrophobicContact CG1-CB 4.28Å; V53-E56 HydrophobicContact CG1-CG 3.86Å; V53-E56 PolarHBondContact O-N 3.12Å; S54-E56 PolarHBondContact O-N 3.33Å
57	E	89	Confident	85.5	Confident	162 Å²	162	51.6 Å²	51.6	76%	0.757	27%	0.265	S	S	*	.			trans	-64.7	145.2	168.5	-66.9	-177.4	169.6	0	0	109.8	F59	E57-F59 WeakPolarHBondContact O-CD1 3.21Å
58	N	92.4	Very high	84.5	Confident	40 Å²	40	56.1 Å²	56.1	21%	0.214	30%	0.295	C	S	.	.			trans	-69.6	140.7	179.1	-58.8	-72.7	0	0	0	110	H104 G106 R107	N58-H104 HydrophobicContact CB-CB 4.42Å; N58-H104 WeakPolarHBondContact CB-O 3.36Å; N58-H104 PolarHBondContact O-N 2.83Å; N58-G106 WeakPolarHBondContact CB-O 3.2Å; N58-G106 VanDerWaalsContact CG-C 3.46Å; N58-G106 VanDerWaalsContact CG-O 3.31Å; N58-G106 VanDerWaalsContact ND2-C 3.31Å; N58-R107 WeakPolarHBondContact OD1-CA 3.21Å
59	F	93.8	Very high	83.4	Confident	21 Å²	21	58.6 Å²	58.6	9%	0.092	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	160.2	177.9	63.2	-92	0	0	0	110.8	P51 E57 R101 F102 F148	P51-F59 HydrophobicContact CB-CZ 4.47Å; P51-F59 HydrophobicContact CG-CD2 4Å; P51-F59 HydrophobicContact CG-CE1 4.09Å; P51-F59 HydrophobicContact CG-CE2 3.3Å; P51-F59 HydrophobicContact CG-CZ 3.36Å; E57-F59 WeakPolarHBondContact O-CD1 3.21Å; F59-R101 HydrophobicContact CD2-CB 4.19Å; F59-R101 HydrophobicContact CD2-CG 4.01Å; F59-R101 VanDerWaalsContact CE2-CD 3.45Å; F59-R101 HydrophobicContact CE2-CG 4.15Å; F59-F102 CarbonylContact C-O 3.54Å; F59-F102 WeakPolarHBondContact CA-O 3.33Å; F59-F102 VanDerWaalsContact CB-O 3.24Å; F59-F102 WeakPolarHBondContact CB-O 3.43Å; F59-F148 HydrophobicContact CB-CE2 4.36Å
60	V	94.1	Very high	82.1	Confident	0 Å²	0	65.9 Å²	65.9	0%	0	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	140.2	164	171.6	0	0	0	0	107.8	L49 R101 F102 H104 V108 I111 T123	L49-V60 CarbonylContact O-C 3.53Å; L49-V60 WeakPolarHBondContact O-CA 3.29Å; V60-R101 CarbonylContact O-C 3.5Å; V60-R101 WeakPolarHBondContact O-CA 3.38Å; V60-F102 HydrophobicContact CB-CD1 4.37Å; V60-F102 HydrophobicContact CB-CD2 4.16Å; V60-F102 HydrophobicContact CB-CE1 3.85Å; V60-F102 HydrophobicContact CB-CE2 3.61Å; V60-F102 HydrophobicContact CB-CZ 3.45Å; V60-F102 VanDerWaalsContact CB-CZ 3.45Å; V60-F102 HydrophobicContact CG1-CE1 3.65Å; V60-F102 HydrophobicContact CG1-CE2 4.09Å; V60-F102 HydrophobicContact CG1-CZ 3.39Å; V60-F102 HydrophobicContact CG2-CE2 4Å; V60-F102 HydrophobicContact CG2-CZ 4.13Å; V60-F102 PolarHBondContact N-O 3.28Å; V60-F102 PolarHBondContact O-N 2.87Å; V60-H104 HydrophobicContact CG2-CB 4.19Å; V60-V108 HydrophobicContact CG2-CG2 3.94Å; V60-I111 HydrophobicContact CB-CD1 4.38Å; V60-I111 HydrophobicContact CG1-CD1 3.39Å; V60-I111 HydrophobicContact CG2-CD1 4.04Å; V60-T123 HydrophobicContact CG2-CG2 4.05Å
61	S	92	Very high	80.8	Confident	6 Å²	6	69.5 Å²	69.5	4%	0.042	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	145.3	173	72.3	0	0	0	0	112	L49 L100	L49-S61 WeakPolarHBondContact CB-OG 3.27Å; L49-S61 PolarHBondContact N-O 2.8Å; L49-S61 PolarHBondContact O-N 2.72Å; S61-L100 VanDerWaalsContact CA-O 3.3Å; S61-L100 WeakPolarHBondContact CA-O 3.37Å
62	I	91.4	Very high	79.9	Confident	4 Å²	4	71.3 Å²	71.3	2%	0.021	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	119.8	167.5	-51.8	-176.9	0	0	0	106.2	L33 R46 A47 L48 I99 L100 V135	L33-I62 HydrophobicContact CD1-CD1 3.98Å; L33-I62 HydrophobicContact CD2-CD1 4.22Å; L33-I62 HydrophobicContact CD2-CG2 4.39Å; R46-I62 HydrophobicContact CB-CG2 4.42Å; A47-I62 WeakPolarHBondContact O-CA 3.33Å; L48-I62 HydrophobicContact CD2-CD1 4.29Å; L48-I62 HydrophobicContact CD2-CG1 3.81Å; L48-I62 HydrophobicContact CD2-CG2 4.48Å; I62-I99 HydrophobicContact CG2-CD1 4.24Å; I62-I99 WeakPolarHBondContact O-CB 3.13Å; I62-I99 PolarHBondContact O-N 2.9Å; I62-L100 HydrophobicContact CB-CD1 4.4Å; I62-L100 HydrophobicContact CB-CG 4.27Å; I62-L100 HydrophobicContact CD1-CD1 3.97Å; I62-L100 HydrophobicContact CD1-CD2 4.34Å; I62-L100 HydrophobicContact CD1-CG 4.2Å; I62-L100 HydrophobicContact CG1-CD1 3.93Å; I62-L100 HydrophobicContact CG1-CG 4.26Å; I62-L100 PolarHBondContact N-O 3.25Å; I62-L100 PolarHBondContact O-N 2.91Å; I62-V135 HydrophobicContact CD1-CB 4.01Å; I62-V135 HydrophobicContact CD1-CG1 4.08Å; I62-V135 HydrophobicContact CD1-CG2 3.95Å
63	I	89.1	Confident	79.1	Confident	10 Å²	10	69.6 Å²	69.6	5%	0.051	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	146.8	175.8	63	157.7	0	0	0	110.1	R46 A47 L49 F65 M96 D97	R46-I63 CarbonylContact C-O 3.49Å; R46-I63 WeakPolarHBondContact CA-O 3.41Å; A47-I63 HydrophobicContact CB-CD1 4.16Å; A47-I63 HydrophobicContact CB-CG1 3.83Å; A47-I63 PolarHBondContact N-O 3.36Å; A47-I63 PolarHBondContact O-N 3.03Å; L49-I63 HydrophobicContact CD1-CD1 3.78Å; L49-I63 HydrophobicContact CD1-CG1 3.99Å; L49-I63 HydrophobicContact CD1-CG2 3.75Å; L49-I63 HydrophobicContact CG-CD1 4.34Å; L49-I63 HydrophobicContact CG-CG1 4.25Å; L49-I63 HydrophobicContact CG-CG2 4.49Å; I63-F65 HydrophobicContact CD1-CD1 4.35Å; I63-M96 HydrophobicContact CD1-CB 4.2Å; I63-M96 HydrophobicContact CD1-CG 4.37Å; I63-M96 HydrophobicContact CD1-SD 3.89Å; I63-D97 CarbonylContact C-O 3.59Å; I63-D97 WeakPolarHBondContact CA-O 3.4Å
64	G	85.1	Confident	78.3	Confident	2 Å²	2	69.3 Å²	69.3	2%	0.021	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	141.6	169.9	0	0	0	0	0	109.9	H45 M96 D97	H45-G64 CarbonylContact O-C 3.59Å; H45-G64 WeakPolarHBondContact O-CA 3.39Å; G64-M96 WeakPolarHBondContact O-CA 3.22Å; G64-D97 PolarHBondContact N-O 3.06Å; G64-D97 PolarHBondContact O-N 3.15Å
65	F	83.2	Confident	77.6	Confident	33 Å²	33	74.8 Å²	74.8	15%	0.145	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.2	155.9	174.6	63.1	-86.4	0	0	0	110.7	L5 H45 A47 I63 M96	L5-F65 HydrophobicContact CD2-CZ 3.68Å; H45-F65 HydrophobicContact CB-CD1 4.48Å; H45-F65 HydrophobicContact CB-CD2 4.22Å; H45-F65 HydrophobicContact CB-CE1 3.95Å; H45-F65 HydrophobicContact CB-CE2 3.66Å; H45-F65 HydrophobicContact CB-CZ 3.5Å; H45-F65 PolarHBondContact N-O 3.04Å; H45-F65 PolarHBondContact O-N 3.35Å; A47-F65 HydrophobicContact CB-CE1 3.89Å; I63-F65 HydrophobicContact CD1-CD1 4.35Å; F65-M96 HydrophobicContact CB-CB 4.39Å; F65-M96 HydrophobicContact CB-CG 3.84Å
66	R	79.5	Confident	77.1	Confident	126 Å²	126	70 Å²	70	48%	0.475	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	117	178.2	-161.3	179.2	-118.6	-179.8	-5.4	110.9	D41 G43 H94	D41-R66 IonicContact OD1-NH2 3.42Å; D41-R66 IonicContact OD2-CZ 3.79Å; D41-R66 VanDerWaalsContact OD2-CZ 3.28Å; D41-R66 IonicContact OD2-NE 3.06Å; D41-R66 PolarHBondContact OD2-NE 3.08Å; D41-R66 VanDerWaalsContact OD2-NE 3.12Å; D41-R66 IonicContact OD2-NH2 2.86Å; D41-R66 PolarHBondContact OD2-NH2 3.11Å; G43-R66 CarbonylContact O-C 3.44Å; G43-R66 WeakPolarHBondContact O-CA 2.85Å; G43-R66 WeakPolarHBondContact O-CG 3.49Å; R66-H94 PolarHBondContact O-ND1 2.73Å
67	A	75.5	Confident	76.5	Confident	24 Å²	24	68.2 Å²	68.2	20%	0.198	36%	0.36	C	S	.	.	P	Polyproline II helix	trans	-68.8	145.6	173.2	0	0	0	0	0	110.5	G43 H45 M69	G43-A67 PolarHBondContact O-N 3.01Å; H45-A67 WeakPolarHBondContact CD2-CB 3.31Å; H45-A67 VanDerWaalsContact NE2-CB 3.33Å; H45-A67 WeakPolarHBondContact NE2-CB 3.5Å; A67-M69 PolarHBondContact O-N 3.31Å
68	P	68.9	Low	75.8	Confident	97 Å²	97	64.6 Å²	64.6	63%	0.63	36%	0.358	S	S	*	.	P	Polyproline II helix	trans	-62.6	124.1	167.6	-15.4	29.1	0	0	0	109.7
69	M	67	Low	75	Confident	67 Å²	67	69.6 Å²	69.6	33%	0.33	38%	0.38	S	S	.	.	P	Polyproline II helix	trans	-91.5	147.3	168.5	-71.3	176.4	159.4	0	0	109.6	P42 A67 S71 N72	P42-M69 HydrophobicContact CB-CE 3.66Å; P42-M69 HydrophobicContact CG-CE 3.7Å; P42-M69 WeakPolarHBondContact O-CE 3.41Å; A67-M69 PolarHBondContact O-N 3.31Å; M69-S71 PolarHBondContact O-N 2.95Å; M69-S71 VanDerWaalsContact O-N 3.09Å; M69-N72 WeakPolarHBondContact O-CB 3.02Å; M69-N72 PolarHBondContact O-N 3.19Å
70	E	63.8	Low	73.9	Confident	183 Å²	183	71.1 Å²	71.1	86%	0.855	39%	0.388	S	S	*	.	G	3₁₀ helix	trans	-51.6	-34.7	178.2	-70.6	-173.8	163.7	0	0	112.7	N72 V73	E70-N72 PolarHBondContact O-N 3.27Å; E70-V73 PolarHBondContact O-N 3.43Å; E70-V73 VanDerWaalsContact O-N 3.16Å
71	S	61.8	Low	72.8	Confident	99 Å²	99	76.2 Å²	76.2	69%	0.692	41%	0.414	S	S	*	.	G	3₁₀ helix	trans	-59.5	-16.6	176.6	64.1	0	0	0	0	114.4	M69	M69-S71 PolarHBondContact O-N 2.95Å; M69-S71 VanDerWaalsContact O-N 3.09Å
72	N	58.7	Low	72	Confident	78 Å²	78	79.7 Å²	79.7	42%	0.417	44%	0.444	S	S	.	.	G	3₁₀ helix	trans	-107.1	0.6	-176.3	-62.2	-22.3	0	0	0	113.4	M69 E70 P74	M69-N72 WeakPolarHBondContact O-CB 3.02Å; M69-N72 PolarHBondContact O-N 3.19Å; E70-N72 PolarHBondContact O-N 3.27Å; N72-P74 VanDerWaalsContact O-CD 3.27Å; N72-P74 WeakPolarHBondContact O-CD 3.46Å
73	V	59.4	Low	71.2	Confident	101 Å²	101	85.8 Å²	85.8	61%	0.612	47%	0.472	S	S	*	.			trans	-81.7	112.3	176.5	-174.2	0	0	0	0	107.7	E70 E75	E70-V73 PolarHBondContact O-N 3.43Å; E70-V73 VanDerWaalsContact O-N 3.16Å; V73-E75 PolarHBondContact O-N 2.83Å
74	P	59.5	Low	70	Confident	56 Å²	56	95 Å²	95	36%	0.364	51%	0.506	S	S	.	.	P	Polyproline II helix	trans	-63.5	137.8	174.5	-15.3	31.3	0	0	0	108.9	N72 L76 T88 T90	N72-P74 VanDerWaalsContact O-CD 3.27Å; N72-P74 WeakPolarHBondContact O-CD 3.46Å; P74-L76 PolarHBondContact O-N 2.88Å; P74-T88 HydrophobicContact CB-CG2 4.11Å; P74-T88 VanDerWaalsContact CD-OG1 3.32Å; P74-T88 WeakPolarHBondContact CD-OG1 3.12Å; P74-T88 HydrophobicContact CG-CG2 4.09Å; P74-T88 WeakPolarHBondContact CG-OG1 3.49Å; P74-T90 HydrophobicContact CG-CG2 4.11Å
75	E	64.6	Low	68.8	Low	188 Å²	188	100.7 Å²	100.7	88%	0.879	53%	0.532	S	S	*	.	P	Polyproline II helix	trans	-58.4	122.6	167.7	-74.6	-173.6	164.7	0	0	108.6	V73 T77	V73-E75 PolarHBondContact O-N 2.83Å; E75-T77 PolarHBondContact O-N 2.95Å
76	L	67.1	Low	67.6	Low	63 Å²	63	106.5 Å²	106.5	33%	0.33	56%	0.558	S	S	.	*	P	Polyproline II helix	trans	-62.1	129.9	174.5	-71.3	163.4	0	0	0	108.9	P74 E80 L81 F86 T88	P74-L76 PolarHBondContact O-N 2.88Å; L76-E80 HydrophobicContact CB-CB 4.46Å; L76-E80 HydrophobicContact CD2-CB 3.96Å; L76-L81 HydrophobicContact CD1-CD1 4.21Å; L76-F86 HydrophobicContact CD1-CD1 3.97Å; L76-F86 HydrophobicContact CD1-CE1 4.33Å; L76-T88 HydrophobicContact CD2-CG2 4.3Å
77	T	71.6	Confident	66.6	Low	72 Å²	72	103.4 Å²	103.4	44%	0.442	56%	0.564	S	S	.	*	P	Polyproline II helix	trans	-63.5	155.7	170.6	62	0	0	0	0	110.2	E75 E79 E80 L81	E75-T77 PolarHBondContact O-N 2.95Å; T77-E79 PolarHBondContact O-N 2.82Å; T77-E79 VanDerWaalsContact O-N 3.14Å; T77-E80 WeakPolarHBondContact CB-OE2 3.19Å; T77-E80 PolarHBondContact N-OE2 3.31Å; T77-E80 PolarHBondContact O-N 3Å; T77-E80 VanDerWaalsContact O-N 3.14Å; T77-E80 VanDerWaalsContact OG1-CD 3.22Å; T77-E80 VanDerWaalsContact OG1-CG 3.23Å; T77-E80 WeakPolarHBondContact OG1-CG 3.36Å; T77-E80 PolarHBondContact OG1-N 2.88Å; T77-E80 PolarHBondContact OG1-OE2 3.43Å; T77-L81 PolarHBondContact O-N 3.31Å
78	A	74.4	Confident	65.6	Low	86 Å²	86	104.3 Å²	104.3	71%	0.711	57%	0.568	S	S	*	*	H	α-helix	trans	-58.1	-28.8	177.9	0	0	0	0	0	112.8	A82	A78-A82 VanDerWaalsContact O-CB 3.31Å; A78-A82 WeakPolarHBondContact O-CB 3.32Å; A78-A82 PolarHBondContact O-N 2.99Å; A78-A82 VanDerWaalsContact O-N 3.08Å
79	E	75.1	Confident	64.8	Low	146 Å²	146	111 Å²	111	68%	0.682	58%	0.582	S	S	*	*	H	α-helix	trans	-71.2	-48.3	175.3	-65.2	-179.3	170.7	0	0	111.4	T77 L81 A82 H83	T77-E79 PolarHBondContact O-N 2.82Å; T77-E79 VanDerWaalsContact O-N 3.14Å; E79-L81 VanDerWaalsContact C-N 3.31Å; E79-L81 PolarHBondContact O-N 2.92Å; E79-A82 WeakPolarHBondContact O-CB 3.34Å; E79-A82 PolarHBondContact O-N 3.02Å; E79-A82 VanDerWaalsContact O-N 3.11Å; E79-H83 PolarHBondContact O-CD2 3.09Å; E79-H83 PolarHBondContact O-N 3.3Å
80	E	69.8	Low	64.3	Low	53 Å²	53	110 Å²	110	25%	0.248	58%	0.58	C	S	.	*	H	α-helix	trans	-60.2	-40.6	176.3	-71.8	162.7	147.4	0	0	111.8	L76 T77 A82 H83 R84 E85	L76-E80 HydrophobicContact CB-CB 4.46Å; L76-E80 HydrophobicContact CD2-CB 3.96Å; T77-E80 WeakPolarHBondContact CB-OE2 3.19Å; T77-E80 PolarHBondContact N-OE2 3.31Å; T77-E80 PolarHBondContact O-N 3Å; T77-E80 VanDerWaalsContact O-N 3.14Å; T77-E80 VanDerWaalsContact OG1-CD 3.22Å; T77-E80 VanDerWaalsContact OG1-CG 3.23Å; T77-E80 WeakPolarHBondContact OG1-CG 3.36Å; T77-E80 PolarHBondContact OG1-N 2.88Å; T77-E80 PolarHBondContact OG1-OE2 3.43Å; E80-A82 VanDerWaalsContact C-N 3.35Å; E80-H83 CarbonylContact O-C 3.55Å; E80-H83 PolarHBondContact O-N 3.34Å; E80-R84 PolarHBondContact O-N 3.18Å; E80-E85 PolarHBondContact O-N 3.33Å
81	L	71.3	Confident	63.7	Low	106 Å²	106	107.5 Å²	107.5	56%	0.555	58%	0.579	S	S	*	*	H	α-helix	trans	-64.3	-39.6	175.1	-161.6	79.2	0	0	0	111.7	L76 T77 E79 R84	L76-L81 HydrophobicContact CD1-CD1 4.21Å; T77-L81 PolarHBondContact O-N 3.31Å; E79-L81 VanDerWaalsContact C-N 3.31Å; E79-L81 PolarHBondContact O-N 2.92Å; L81-R84 PolarHBondContact O-N 3.45Å
82	A	74.7	Confident	63.3	Low	80 Å²	80	105.3 Å²	105.3	66%	0.661	56%	0.562	S	S	*	*	H	α-helix	trans	-68.2	-34.7	176.6	0	0	0	0	0	112.4	A78 E79 E80 R84	A78-A82 VanDerWaalsContact O-CB 3.31Å; A78-A82 WeakPolarHBondContact O-CB 3.32Å; A78-A82 PolarHBondContact O-N 2.99Å; A78-A82 VanDerWaalsContact O-N 3.08Å; E79-A82 WeakPolarHBondContact O-CB 3.34Å; E79-A82 PolarHBondContact O-N 3.02Å; E79-A82 VanDerWaalsContact O-N 3.11Å; E80-A82 VanDerWaalsContact C-N 3.35Å; A82-R84 VanDerWaalsContact C-N 3.32Å
83	H	75.3	Confident	63.2	Low	132 Å²	132	107.4 Å²	107.4	61%	0.611	58%	0.577	S	S	*	*	H	α-helix	trans	-82.7	-5.7	176.9	-69.8	-60.7	0	0	0	114	E79 E80 E85	E79-H83 PolarHBondContact O-CD2 3.09Å; E79-H83 PolarHBondContact O-N 3.3Å; E80-H83 CarbonylContact O-C 3.55Å; E80-H83 PolarHBondContact O-N 3.34Å; H83-E85 HydrophobicContact CB-CG 3.9Å; H83-E85 PolarHBondContact O-N 2.99Å
84	R	64.7	Low	63.3	Low	203 Å²	203	106.5 Å²	106.5	77%	0.766	57%	0.566	S	S	*	*	T	Hydrogen-bonded Turn	trans	56.7	32.9	-174.1	-59.3	-178.2	173.4	-172.6	-3.2	112.5	E80 L81 A82 F86	E80-R84 PolarHBondContact O-N 3.18Å; L81-R84 PolarHBondContact O-N 3.45Å; A82-R84 VanDerWaalsContact C-N 3.32Å; R84-F86 HydrophobicContact CB-CD2 4.46Å; R84-F86 HydrophobicContact CB-CE2 3.83Å; R84-F86 HydrophobicContact CG-CE2 4.4Å; R84-F86 VanDerWaalsContact O-CD2 3.27Å; R84-F86 WeakPolarHBondContact O-CD2 3.47Å; R84-F86 PolarHBondContact O-N 3.05Å; R84-F86 VanDerWaalsContact O-N 3.15Å
85	E	58.9	Low	63.9	Low	121 Å²	121	112.2 Å²	112.2	57%	0.565	58%	0.581	S	S	*	*			trans	-86.1	80.6	177.2	-69.9	-176.1	174.1	0	0	109.2	E80 H83 G87	E80-E85 PolarHBondContact O-N 3.33Å; H83-E85 HydrophobicContact CB-CG 3.9Å; H83-E85 PolarHBondContact O-N 2.99Å; E85-G87 VanDerWaalsContact C-N 3.3Å; E85-G87 PolarHBondContact O-N 3.22Å
86	F	58.5	Low	64.8	Low	156 Å²	156	109 Å²	109	68%	0.684	57%	0.567	S	S	*	*			trans	-81.9	76.1	175.4	-55	-77.4	0	0	0	109.6	L76 R84	L76-F86 HydrophobicContact CD1-CD1 3.97Å; L76-F86 HydrophobicContact CD1-CE1 4.33Å; R84-F86 HydrophobicContact CB-CD2 4.46Å; R84-F86 HydrophobicContact CB-CE2 3.83Å; R84-F86 HydrophobicContact CG-CE2 4.4Å; R84-F86 VanDerWaalsContact O-CD2 3.27Å; R84-F86 WeakPolarHBondContact O-CD2 3.47Å; R84-F86 PolarHBondContact O-N 3.05Å; R84-F86 VanDerWaalsContact O-N 3.15Å
87	G	58.8	Low	65.6	Low	60 Å²	60	107.9 Å²	107.9	62%	0.619	56%	0.562	S	S	*	*			trans	177.6	77.3	-179	0	0	0	0	0	113.3	E85	E85-G87 VanDerWaalsContact C-N 3.3Å; E85-G87 PolarHBondContact O-N 3.22Å
88	T	53.3	Low	66.4	Low	44 Å²	44	106.5 Å²	106.5	27%	0.27	55%	0.553	S	S	.	*			trans	-71	133.2	168.4	47.4	0	0	0	0	110.2	P74 L76 T90	P74-T88 HydrophobicContact CB-CG2 4.11Å; P74-T88 VanDerWaalsContact CD-OG1 3.32Å; P74-T88 WeakPolarHBondContact CD-OG1 3.12Å; P74-T88 HydrophobicContact CG-CG2 4.09Å; P74-T88 WeakPolarHBondContact CG-OG1 3.49Å; L76-T88 HydrophobicContact CD2-CG2 4.3Å; T88-T90 VanDerWaalsContact C-N 3.32Å; T88-T90 PolarHBondContact O-N 2.83Å
89	Y	53.5	Low	67	Low	237 Å²	237	102.6 Å²	102.6	93%	0.929	52%	0.52	S	S	*	.			trans	-65.2	90.4	166.3	-74.3	-86.2	0	0	0	109.3
90	T	54.7	Low	67.7	Low	47 Å²	47	95.7 Å²	95.7	29%	0.288	49%	0.488	S	S	.	.			trans	-73.3	139.2	163.2	62.1	0	0	0	0	107.9	P74 T88 V92	P74-T90 HydrophobicContact CG-CG2 4.11Å; T88-T90 VanDerWaalsContact C-N 3.32Å; T88-T90 PolarHBondContact O-N 2.83Å; T90-V92 PolarHBondContact O-N 3.17Å; T90-V92 VanDerWaalsContact O-N 3.11Å
91	P	51.4	Low	68.8	Low	130 Å²	130	96 Å²	96	84%	0.844	49%	0.487	S	S	*	.	S	Bend	trans	-69.7	-0.8	173.6	28.2	-33.7	0	0	0	112.6	T93	P91-T93 PolarHBondContact O-N 2.94Å; P91-T93 VanDerWaalsContact O-N 3.07Å
92	V	54.4	Low	69.9	Low	53 Å²	53	91 Å²	91	32%	0.321	46%	0.46	S	S	.	.			trans	-74	99.9	174.9	-175.1	0	0	0	0	107.4	T90 H94	T90-V92 PolarHBondContact O-N 3.17Å; T90-V92 VanDerWaalsContact O-N 3.11Å; V92-H94 VanDerWaalsContact C-N 3.33Å; V92-H94 PolarHBondContact O-CD2 2.97Å; V92-H94 VanDerWaalsContact O-CD2 3.25Å; V92-H94 PolarHBondContact O-N 2.65Å
93	T	55.5	Low	70.9	Confident	121 Å²	121	89.1 Å²	89.1	74%	0.742	44%	0.442	S	S	*	.			trans	-63.5	100.6	164.1	54.4	0	0	0	0	107.2	P91 R95	P91-T93 PolarHBondContact O-N 2.94Å; P91-T93 VanDerWaalsContact O-N 3.07Å; T93-R95 PolarHBondContact O-N 3.4Å
94	H	63.1	Low	71.8	Confident	83 Å²	83	83.5 Å²	83.5	38%	0.384	42%	0.415	S	S	.	.			trans	-71.7	69.4	169	-66.6	-82	0	0	0	108.5	R66 V92	R66-H94 PolarHBondContact O-ND1 2.73Å; V92-H94 VanDerWaalsContact C-N 3.33Å; V92-H94 PolarHBondContact O-CD2 2.97Å; V92-H94 VanDerWaalsContact O-CD2 3.25Å; V92-H94 PolarHBondContact O-N 2.65Å
95	R	70.9	Confident	73	Confident	176 Å²	176	78.3 Å²	78.3	66%	0.664	40%	0.4	S	S	*	.			trans	-81.2	132.8	178.1	-170.6	176.5	175.1	175.6	-1	108.3	T93 D97	T93-R95 PolarHBondContact O-N 3.4Å; R95-D97 WeakPolarHBondContact CD-OD1 3.43Å; R95-D97 IonicContact CZ-OD1 3.06Å; R95-D97 IonicContact NE-OD1 3.03Å; R95-D97 PolarHBondContact NE-OD1 2.91Å; R95-D97 IonicContact NH2-OD1 3.67Å
96	M	83.1	Confident	74.5	Confident	120 Å²	120	73.7 Å²	73.7	59%	0.591	38%	0.384	S	S	*	.			trans	-87.1	122.2	163.7	-59.3	-177.4	172.7	0	0	106.9	I63 G64 F65	I63-M96 HydrophobicContact CD1-CB 4.2Å; I63-M96 HydrophobicContact CD1-CG 4.37Å; I63-M96 HydrophobicContact CD1-SD 3.89Å; G64-M96 WeakPolarHBondContact O-CA 3.22Å; F65-M96 HydrophobicContact CB-CB 4.39Å; F65-M96 HydrophobicContact CB-CG 3.84Å
97	D	85.3	Confident	76	Confident	40 Å²	40	71.6 Å²	71.6	21%	0.214	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	131	178.1	-70.6	-51	0	0	0	109.3	L27 I63 G64 R95 I99	L27-D97 HydrophobicContact CD2-CB 4.01Å; I63-D97 CarbonylContact C-O 3.59Å; I63-D97 WeakPolarHBondContact CA-O 3.4Å; G64-D97 PolarHBondContact N-O 3.06Å; G64-D97 PolarHBondContact O-N 3.15Å; R95-D97 WeakPolarHBondContact CD-OD1 3.43Å; R95-D97 IonicContact CZ-OD1 3.06Å; R95-D97 IonicContact NE-OD1 3.03Å; R95-D97 PolarHBondContact NE-OD1 2.91Å; R95-D97 IonicContact NH2-OD1 3.67Å; D97-I99 PolarHBondContact O-N 2.93Å
98	T	87.9	Confident	77.5	Confident	43 Å²	43	69.3 Å²	69.3	26%	0.264	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	120.8	169.9	-52	0	0	0	0	108.7	R101 D146	T98-R101 HydrophobicContact CG2-CG 3.66Å; T98-D146 WeakPolarHBondContact CB-OD1 3.12Å; T98-D146 VanDerWaalsContact CG2-OD1 3.23Å; T98-D146 WeakPolarHBondContact CG2-OD1 3.4Å; T98-D146 WeakPolarHBondContact O-CA 3.21Å; T98-D146 PolarHBondContact O-N 2.81Å
99	I	86.9	Confident	79.2	Confident	4 Å²	4	70.8 Å²	70.8	2%	0.021	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	-58	174.4	-58.3	178.8	0	0	0	107.6	L30 R46 I62 D97 L142 D146 K147	L30-I99 HydrophobicContact CD1-CB 4.26Å; L30-I99 HydrophobicContact CD1-CD1 3.87Å; L30-I99 HydrophobicContact CD1-CG1 3.7Å; L30-I99 HydrophobicContact CD1-CG2 3.78Å; L30-I99 HydrophobicContact CD2-CD1 4.19Å; R46-I99 HydrophobicContact CG-CD1 4.12Å; I62-I99 HydrophobicContact CG2-CD1 4.24Å; I62-I99 WeakPolarHBondContact O-CB 3.13Å; I62-I99 PolarHBondContact O-N 2.9Å; D97-I99 PolarHBondContact O-N 2.93Å; I99-L142 HydrophobicContact CG2-CD2 4.2Å; I99-D146 PolarHBondContact O-N 2.94Å; I99-K147 PolarHBondContact O-N 2.81Å
100	L	90.6	Very high	80.9	Confident	0 Å²	0	60.5 Å²	60.5	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150	166.6	178.7	68.4	81.1	0	0	0	112.3	L33 S61 I62 F102 L137 L142 K147 I149	L33-L100 HydrophobicContact CD1-CD2 3.55Å; S61-L100 VanDerWaalsContact CA-O 3.3Å; S61-L100 WeakPolarHBondContact CA-O 3.37Å; I62-L100 HydrophobicContact CB-CD1 4.4Å; I62-L100 HydrophobicContact CB-CG 4.27Å; I62-L100 HydrophobicContact CD1-CD1 3.97Å; I62-L100 HydrophobicContact CD1-CD2 4.34Å; I62-L100 HydrophobicContact CD1-CG 4.2Å; I62-L100 HydrophobicContact CG1-CD1 3.93Å; I62-L100 HydrophobicContact CG1-CG 4.26Å; I62-L100 PolarHBondContact N-O 3.25Å; I62-L100 PolarHBondContact O-N 2.91Å; L100-F102 HydrophobicContact CD1-CD1 3.65Å; L100-F102 HydrophobicContact CD1-CE1 4.1Å; L100-L137 HydrophobicContact CD2-CD1 3.38Å; L100-L142 HydrophobicContact CD2-CD2 3.68Å; L100-K147 CarbonylContact C-O 3.6Å; L100-K147 WeakPolarHBondContact CA-O 3.15Å; L100-K147 HydrophobicContact CB-CB 4.4Å; L100-K147 WeakPolarHBondContact CB-O 3.27Å; L100-I149 HydrophobicContact CD1-CD1 4.16Å; L100-I149 HydrophobicContact CD2-CD1 4.15Å
101	R	92.7	Very high	82.8	Confident	61 Å²	61	58.8 Å²	58.8	23%	0.23	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	148.6	173.9	-61.8	-171.4	-83.5	151.3	-4.4	109.7	F59 V60 T98 D146 K147 F148 I149	F59-R101 HydrophobicContact CD2-CB 4.19Å; F59-R101 HydrophobicContact CD2-CG 4.01Å; F59-R101 VanDerWaalsContact CE2-CD 3.45Å; F59-R101 HydrophobicContact CE2-CG 4.15Å; V60-R101 CarbonylContact O-C 3.5Å; V60-R101 WeakPolarHBondContact O-CA 3.38Å; T98-R101 HydrophobicContact CG2-CG 3.66Å; R101-D146 IonicContact CZ-OD1 3.94Å; R101-D146 IonicContact CZ-OD2 2.96Å; R101-D146 IonicContact NE-OD1 3.68Å; R101-D146 PolarHBondContact NE-OD1 2.96Å; R101-D146 IonicContact NE-OD2 3.17Å; R101-D146 IonicContact NH2-OD1 3.3Å; R101-D146 PolarHBondContact NH2-OD1 2.8Å; R101-D146 IonicContact NH2-OD2 3.16Å; R101-D146 PolarHBondContact NH2-OD2 2.85Å; R101-K147 PolarHBondContact N-O 3.3Å; R101-F148 HydrophobicContact CB-CD2 3.76Å; R101-F148 HydrophobicContact CB-CE2 4.26Å; R101-F148 CarbonylContact O-C 3.53Å; R101-F148 WeakPolarHBondContact O-CA 3.25Å; R101-I149 PolarHBondContact O-N 3.36Å
102	F	94.5	Very high	84.7	Confident	0 Å²	0	53.2 Å²	53.2	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	149.8	171	56	-90.8	0	0	0	110.6	F59 V60 L100 F133 V135 I149 L151	F59-F102 CarbonylContact C-O 3.54Å; F59-F102 WeakPolarHBondContact CA-O 3.33Å; F59-F102 VanDerWaalsContact CB-O 3.24Å; F59-F102 WeakPolarHBondContact CB-O 3.43Å; V60-F102 HydrophobicContact CB-CD1 4.37Å; V60-F102 HydrophobicContact CB-CD2 4.16Å; V60-F102 HydrophobicContact CB-CE1 3.85Å; V60-F102 HydrophobicContact CB-CE2 3.61Å; V60-F102 HydrophobicContact CB-CZ 3.45Å; V60-F102 VanDerWaalsContact CB-CZ 3.45Å; V60-F102 HydrophobicContact CG1-CE1 3.65Å; V60-F102 HydrophobicContact CG1-CE2 4.09Å; V60-F102 HydrophobicContact CG1-CZ 3.39Å; V60-F102 HydrophobicContact CG2-CE2 4Å; V60-F102 HydrophobicContact CG2-CZ 4.13Å; V60-F102 PolarHBondContact N-O 3.28Å; V60-F102 PolarHBondContact O-N 2.87Å; L100-F102 HydrophobicContact CD1-CD1 3.65Å; L100-F102 HydrophobicContact CD1-CE1 4.1Å; F102-F133 HydrophobicContact CD2-CD1 4.14Å; F102-F133 AromaticContact CD2-CE1 4Å; F102-F133 HydrophobicContact CD2-CE1 4Å; F102-F133 HydrophobicContact CD2-CZ 4.35Å; F102-F133 HydrophobicContact CE2-CB 4.4Å; F102-F133 AromaticContact CE2-CD1 3.63Å; F102-F133 HydrophobicContact CE2-CD1 3.63Å; F102-F133 AromaticContact CE2-CD2 3.84Å; F102-F133 HydrophobicContact CE2-CD2 3.84Å; F102-F133 AromaticContact CE2-CE1 3.72Å; F102-F133 HydrophobicContact CE2-CE1 3.72Å; F102-F133 AromaticContact CE2-CE2 3.91Å; F102-F133 HydrophobicContact CE2-CE2 3.91Å; F102-F133 AromaticContact CE2-CG 3.69Å; F102-F133 HydrophobicContact CE2-CG 3.69Å; F102-F133 AromaticContact CE2-CZ 3.86Å; F102-F133 HydrophobicContact CE2-CZ 3.86Å; F102-F133 HydrophobicContact CZ-CB 4.36Å; F102-F133 HydrophobicContact CZ-CD1 4.39Å; F102-F133 HydrophobicContact CZ-CD2 4.29Å; F102-F133 HydrophobicContact CZ-CG 4.1Å; F102-V135 HydrophobicContact CE1-CG1 4.02Å; F102-V135 HydrophobicContact CZ-CG1 4.33Å; F102-I149 WeakPolarHBondContact CA-O 3.49Å; F102-I149 HydrophobicContact CB-CG1 3.84Å; F102-I149 WeakPolarHBondContact CB-O 3.31Å; F102-L151 HydrophobicContact CB-CB 3.72Å; F102-L151 HydrophobicContact CD1-CD2 4.03Å; F102-L151 HydrophobicContact CD2-CB 4.2Å; F102-L151 HydrophobicContact CD2-CD2 4.21Å; F102-L151 HydrophobicContact CE1-CD2 4.1Å; F102-L151 HydrophobicContact CE2-CD2 4.28Å; F102-L151 HydrophobicContact CG-CB 3.95Å; F102-L151 HydrophobicContact CG-CD2 4.08Å; F102-L151 HydrophobicContact CZ-CD2 4.21Å
103	P	94.3	Very high	86.7	Confident	41 Å²	41	53.1 Å²	53.1	27%	0.266	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.6	148	-177.3	27.1	-34.2	0	0	0	110.9	F148 I149	P103-F148 HydrophobicContact CB-CZ 4.15Å; P103-F148 HydrophobicContact CG-CE1 4.37Å; P103-F148 HydrophobicContact CG-CZ 4.45Å; P103-I149 WeakPolarHBondContact CD-O 3.42Å
104	H	94.3	Very high	88.6	Confident	13 Å²	13	47.8 Å²	47.8	6%	0.06	23%	0.225	C	C	.	.			trans	-131.4	137.7	178	-167.9	-78.1	0	0	0	110.7	N58 V60 G106 V108 T123 F131 F133	N58-H104 HydrophobicContact CB-CB 4.42Å; N58-H104 WeakPolarHBondContact CB-O 3.36Å; N58-H104 PolarHBondContact O-N 2.83Å; V60-H104 HydrophobicContact CG2-CB 4.19Å; H104-G106 PolarHBondContact ND1-O 3.36Å; H104-G106 PolarHBondContact O-N 3.27Å; H104-V108 HydrophobicContact CB-CG2 4.11Å; H104-V108 VanDerWaalsContact CG-CG2 3.49Å; H104-T123 VanDerWaalsContact NE2-CB 3.3Å; H104-T123 WeakPolarHBondContact NE2-CB 3.38Å; H104-T123 PolarHBondContact NE2-OG1 3.47Å; H104-F131 AromaticContact CE1-CD2 3.6Å; H104-F131 AromaticContact CE1-CE2 3.94Å; H104-F131 AromaticContact NE2-CD2 3.57Å; H104-F133 AromaticContact CD2-CE2 3.8Å; H104-F133 AromaticContact CD2-CZ 3.99Å
105	E	91.3	Very high	89.9	Confident	95 Å²	95	46.9 Å²	46.9	44%	0.444	23%	0.227	S	C	.	.	S	Bend	trans	-80.6	112.4	176.1	-69.5	177.2	-154.5	0	0	110.6	S125 F131 R156	E105-S125 WeakPolarHBondContact O-CB 3.36Å; E105-S125 PolarHBondContact O-OG 3.24Å; E105-F131 HydrophobicContact CB-CE1 4.42Å; E105-F131 HydrophobicContact CB-CE2 3.84Å; E105-F131 HydrophobicContact CB-CZ 3.58Å; E105-F131 HydrophobicContact CG-CZ 4.3Å; E105-F131 WeakPolarHBondContact OE2-CZ 3.24Å; E105-R156 IonicContact OE1-CZ 2.87Å; E105-R156 VanDerWaalsContact OE1-CZ 3.22Å; E105-R156 IonicContact OE1-NH1 3.36Å; E105-R156 PolarHBondContact OE1-NH1 2.83Å; E105-R156 IonicContact OE1-NH2 2.72Å; E105-R156 PolarHBondContact OE1-NH2 2.9Å; E105-R156 IonicContact OE2-CZ 3.41Å; E105-R156 IonicContact OE2-NH1 3.92Å; E105-R156 PolarHBondContact OE2-NH1 3.48Å
106	G	89.2	Confident	91	Very high	23 Å²	23	41.2 Å²	41.2	24%	0.237	21%	0.208	C	C	.	.	S	Bend	trans	78.3	168.3	-177.3	0	0	0	0	0	113.6	N58 H104 V108 D126	N58-G106 WeakPolarHBondContact CB-O 3.2Å; N58-G106 VanDerWaalsContact CG-C 3.46Å; N58-G106 VanDerWaalsContact CG-O 3.31Å; N58-G106 VanDerWaalsContact ND2-C 3.31Å; H104-G106 PolarHBondContact ND1-O 3.36Å; H104-G106 PolarHBondContact O-N 3.27Å; G106-V108 PolarHBondContact O-N 3.31Å; G106-D126 WeakPolarHBondContact CA-OD1 3.5Å
107	R	89.7	Confident	91.5	Very high	113 Å²	113	37.1 Å²	37.1	43%	0.426	19%	0.187	S	C	.	.			trans	-68.9	119.6	-179.4	176.9	-177.2	175.4	-160.6	-0.4	109.8	Y52 N58 L109 S125 D126	Y52-R107 HydrophobicContact CD2-CB 4.28Å; Y52-R107 HydrophobicContact CD2-CG 3.74Å; Y52-R107 HydrophobicContact CG-CG 4.2Å; N58-R107 WeakPolarHBondContact OD1-CA 3.21Å; R107-L109 HydrophobicContact CG-CD2 4.32Å; R107-L109 PolarHBondContact O-N 3.41Å; R107-S125 WeakPolarHBondContact O-CA 3.36Å; R107-S125 WeakPolarHBondContact O-CB 3.41Å; R107-D126 WeakPolarHBondContact CB-OD2 3.3Å; R107-D126 PolarHBondContact N-OD1 2.62Å; R107-D126 PolarHBondContact O-N 2.9Å
108	V	91	Very high	91.7	Very high	12 Å²	12	36.9 Å²	36.9	7%	0.073	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.1	121.2	175.3	-175.7	0	0	0	0	109.9	V60 H104 G106 I111	V60-V108 HydrophobicContact CG2-CG2 3.94Å; H104-V108 HydrophobicContact CB-CG2 4.11Å; H104-V108 VanDerWaalsContact CG-CG2 3.49Å; G106-V108 PolarHBondContact O-N 3.31Å; V108-I111 HydrophobicContact CG1-CB 4.22Å
109	L	88.5	Confident	91.9	Very high	75 Å²	75	35 Å²	35	39%	0.393	18%	0.176	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	-38.1	177.4	-59.6	-179.9	0	0	0	111.2	R107 K124	R107-L109 HydrophobicContact CG-CD2 4.32Å; R107-L109 PolarHBondContact O-N 3.41Å; L109-K124 PolarHBondContact N-O 2.72Å
110	Q	90.3	Very high	92.2	Very high	20 Å²	20	35.6 Å²	35.6	9%	0.093	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145	145.8	177.1	-168.4	163.6	-27.5	0	0	110.7	M112 T123 K124 G165 L167	Q110-M112 HydrophobicContact CG-SD 4.26Å; Q110-M112 PolarHBondContact NE2-SD 3.18Å; Q110-T123 WeakPolarHBondContact O-CA 3.43Å; Q110-K124 HydrophobicContact CB-CB 4.24Å; Q110-K124 PolarHBondContact N-O 2.94Å; Q110-K124 PolarHBondContact O-N 2.77Å; Q110-G165 PolarHBondContact OE1-O 3.34Å; Q110-L167 HydrophobicContact CB-CB 4.48Å; Q110-L167 HydrophobicContact CB-CD2 4.46Å; Q110-L167 HydrophobicContact CG-CB 4.16Å; Q110-L167 HydrophobicContact CG-CD2 4.35Å; Q110-L167 PolarHBondContact NE2-O 2.9Å
111	I	93	Very high	92.5	Very high	11 Å²	11	35.6 Å²	35.6	6%	0.056	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	137.9	-179.1	-178.3	160.2	0	0	0	109.9	L48 V60 V108 I121 A122 T123	L48-I111 HydrophobicContact CB-CD1 3.72Å; L48-I111 HydrophobicContact CB-CG1 3.88Å; L48-I111 HydrophobicContact CB-CG2 4.3Å; L48-I111 HydrophobicContact CD1-CD1 4.28Å; L48-I111 HydrophobicContact CD1-CG1 3.96Å; L48-I111 HydrophobicContact CG-CD1 4.47Å; V60-I111 HydrophobicContact CB-CD1 4.38Å; V60-I111 HydrophobicContact CG1-CD1 3.39Å; V60-I111 HydrophobicContact CG2-CD1 4.04Å; V108-I111 HydrophobicContact CG1-CB 4.22Å; I111-I121 HydrophobicContact CD1-CG2 3.89Å; I111-I121 HydrophobicContact CG1-CG2 3.63Å; I111-A122 WeakPolarHBondContact CA-O 3.33Å; I111-T123 HydrophobicContact CB-CG2 4.31Å; I111-T123 HydrophobicContact CD1-CG2 3.82Å; I111-T123 HydrophobicContact CG1-CG2 3.89Å
112	M	93.1	Very high	92.6	Very high	13 Å²	13	32.7 Å²	32.7	6%	0.064	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-163.1	136.7	-173.7	24.8	-171.8	-75.6	0	0	111.8	Q110 A122 L167 C168 W169	Q110-M112 HydrophobicContact CG-SD 4.26Å; Q110-M112 PolarHBondContact NE2-SD 3.18Å; M112-A122 PolarHBondContact N-O 2.72Å; M112-A122 PolarHBondContact O-N 2.94Å; M112-L167 HydrophobicContact CE-CD2 4.46Å; M112-L167 HydrophobicContact CE-CG 4Å; M112-L167 HydrophobicContact CG-CD2 3.59Å; M112-L167 HydrophobicContact CG-CG 4.09Å; M112-L167 HydrophobicContact SD-CB 3.74Å; M112-L167 HydrophobicContact SD-CD2 3.71Å; M112-L167 HydrophobicContact SD-CG 3.56Å; M112-L167 VanDerWaalsContact SD-CG 3.56Å; M112-C168 VanDerWaalsContact CE-C 3.45Å; M112-W169 HydrophobicContact CE-CB 4.2Å; M112-W169 HydrophobicContact CE-CG 3.88Å; M112-W169 PolarHBondContact O-NE1 2.75Å; M112-W169 VanDerWaalsContact O-NE1 3.11Å
113	Y	94.7	Very high	92.6	Very high	51 Å²	51	32.7 Å²	32.7	20%	0.2	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	152.9	174.6	67.2	-108.7	0	0	0	111.2	S4 L5 P118 I120 W169	S4-Y113 WeakPolarHBondContact OG-CD1 3.17Å; S4-Y113 WeakPolarHBondContact OG-CE1 3.5Å; L5-Y113 PolarHBondContact O-OH 3.05Å; Y113-P118 HydrophobicContact CD2-CB 3.93Å; Y113-P118 HydrophobicContact CD2-CG 4.3Å; Y113-P118 HydrophobicContact CE2-CB 4.48Å; Y113-P118 HydrophobicContact CG-CB 4.25Å; Y113-I120 CarbonylContact C-O 3.55Å; Y113-I120 WeakPolarHBondContact CA-O 3.5Å; Y113-W169 VanDerWaalsContact C-CD1 3.47Å; Y113-W169 PolarHBondContact O-NE1 2.98Å
114	M	95.2	Very high	92.4	Very high	9 Å²	9	31 Å²	31	4%	0.044	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	123.2	172.8	-172.6	-168.8	-49.3	0	0	109.7	Q116 E117 P118 I120 W169 E174 G175 L191	M114-Q116 VanDerWaalsContact CG-OE1 3.29Å; M114-Q116 PolarHBondContact O-N 2.94Å; M114-Q116 VanDerWaalsContact O-N 3.15Å; M114-E117 CarbonylContact O-C 3.53Å; M114-E117 PolarHBondContact O-N 3.04Å; M114-E117 VanDerWaalsContact O-N 3.13Å; M114-E117 HydrophobicContact SD-CB 4.25Å; M114-P118 WeakPolarHBondContact O-CA 3.16Å; M114-I120 HydrophobicContact CB-CB 4.19Å; M114-I120 HydrophobicContact CE-CB 3.81Å; M114-I120 HydrophobicContact CE-CG1 4.21Å; M114-I120 HydrophobicContact CE-CG2 3.56Å; M114-I120 PolarHBondContact N-O 3.36Å; M114-W169 HydrophobicContact CB-CD2 3.97Å; M114-W169 HydrophobicContact CB-CE3 4.24Å; M114-W169 HydrophobicContact CB-CG 4.43Å; M114-W169 HydrophobicContact CB-CH2 4.34Å; M114-W169 HydrophobicContact CB-CZ2 4.03Å; M114-W169 HydrophobicContact CB-CZ3 4.45Å; M114-W169 HydrophobicContact CE-CE3 4.26Å; M114-W169 HydrophobicContact CE-CH2 3.53Å; M114-W169 HydrophobicContact CE-CZ2 4.22Å; M114-W169 HydrophobicContact CE-CZ3 3.56Å; M114-W169 HydrophobicContact CG-CD2 4.03Å; M114-W169 HydrophobicContact CG-CE3 3.88Å; M114-W169 HydrophobicContact CG-CZ3 4.17Å; M114-W169 HydrophobicContact SD-CZ3 4.43Å; M114-E174 HydrophobicContact SD-CG 3.84Å; M114-G175 PolarHBondContact SD-N 2.95Å; M114-G175 VanDerWaalsContact SD-N 3.44Å; M114-L191 HydrophobicContact CE-CD1 4.26Å
115	P	91.7	Very high	92.2	Very high	64 Å²	64	30.6 Å²	30.6	42%	0.416	16%	0.156	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.4	-35.6	-175.8	-28.9	35.9	0	0	0	114.7	W169 P171	P115-W169 HydrophobicContact CG-CB 4.36Å; P115-P171 HydrophobicContact CG-CB 4.42Å
116	Q	93.7	Very high	92	Very high	58 Å²	58	29.7 Å²	29.7	27%	0.271	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.4	-28.7	-178.2	-55.4	89.3	-21.7	0	0	113	M114 N170 P171 E174	M114-Q116 VanDerWaalsContact CG-OE1 3.29Å; M114-Q116 PolarHBondContact O-N 2.94Å; M114-Q116 VanDerWaalsContact O-N 3.15Å; Q116-N170 PolarHBondContact NE2-O 3.44Å; Q116-P171 PolarHBondContact NE2-O 3.05Å; Q116-E174 HydrophobicContact CB-CB 4.36Å; Q116-E174 HydrophobicContact CB-CG 4.06Å; Q116-E174 HydrophobicContact CG-CB 4.24Å; Q116-E174 HydrophobicContact CG-CG 4.48Å
117	E	92.5	Very high	91.9	Very high	33 Å²	33	29.7 Å²	29.7	15%	0.154	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140	86.1	178.4	-172.2	65.5	-104	0	0	109.8	K36 M114 T119 I120	K36-E117 WeakPolarHBondContact CE-OE1 3.16Å; K36-E117 WeakPolarHBondContact CE-OE2 3.48Å; K36-E117 IonicContact NZ-OE1 2.88Å; K36-E117 IonicContact NZ-OE2 3.92Å; K36-E117 PolarHBondContact NZ-OE2 2.9Å; M114-E117 CarbonylContact O-C 3.53Å; M114-E117 PolarHBondContact O-N 3.04Å; M114-E117 VanDerWaalsContact O-N 3.13Å; M114-E117 HydrophobicContact SD-CB 4.25Å; E117-T119 PolarHBondContact O-N 2.95Å; E117-I120 HydrophobicContact CB-CG1 4.16Å; E117-I120 HydrophobicContact CG-CG1 3.74Å; E117-I120 PolarHBondContact O-N 3.18Å
118	P	90.4	Very high	91.8	Very high	35 Å²	35	29 Å²	29	23%	0.227	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	-8.8	-170.7	-25.2	36.5	0	0	0	115.4	V35 Y113 M114	V35-P118 HydrophobicContact CB-CB 4.12Å; V35-P118 HydrophobicContact CB-CG 4.31Å; V35-P118 HydrophobicContact CG1-CB 3.97Å; V35-P118 HydrophobicContact CG1-CG 3.9Å; V35-P118 HydrophobicContact CG2-CB 3.96Å; Y113-P118 HydrophobicContact CD2-CB 3.93Å; Y113-P118 HydrophobicContact CD2-CG 4.3Å; Y113-P118 HydrophobicContact CE2-CB 4.48Å; Y113-P118 HydrophobicContact CG-CB 4.25Å; M114-P118 WeakPolarHBondContact O-CA 3.16Å
119	T	91.1	Very high	91.9	Very high	4 Å²	4	32 Å²	32	3%	0.025	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	-17.9	169.6	70.3	0	0	0	0	112.2	V35 E117 D134 V135 N136	V35-T119 HydrophobicContact CG2-CG2 4.34Å; E117-T119 PolarHBondContact O-N 2.95Å; T119-D134 PolarHBondContact OG1-OD1 2.93Å; T119-V135 WeakPolarHBondContact O-CG2 3.35Å; T119-V135 PolarHBondContact O-N 3.29Å; T119-N136 HydrophobicContact CG2-CB 3.98Å
120	I	94.9	Very high	92.1	Very high	16 Å²	16	28.5 Å²	28.5	8%	0.082	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	123.1	175.5	-54.9	-57.8	0	0	0	109.4	Y113 M114 E117 I132 F133 D134 M154 W169	Y113-I120 CarbonylContact C-O 3.55Å; Y113-I120 WeakPolarHBondContact CA-O 3.5Å; M114-I120 HydrophobicContact CB-CB 4.19Å; M114-I120 HydrophobicContact CE-CB 3.81Å; M114-I120 HydrophobicContact CE-CG1 4.21Å; M114-I120 HydrophobicContact CE-CG2 3.56Å; M114-I120 PolarHBondContact N-O 3.36Å; E117-I120 HydrophobicContact CB-CG1 4.16Å; E117-I120 HydrophobicContact CG-CG1 3.74Å; E117-I120 PolarHBondContact O-N 3.18Å; I120-I132 HydrophobicContact CG2-CG2 3.51Å; I120-F133 WeakPolarHBondContact CA-O 3.33Å; I120-D134 HydrophobicContact CD1-CB 3.91Å; I120-M154 HydrophobicContact CD1-CE 3.58Å; I120-W169 HydrophobicContact CG2-CH2 4.22Å; I120-W169 HydrophobicContact CG2-CZ2 4.24Å
121	I	95.4	Very high	92.3	Very high	1 Å²	1	27.7 Å²	27.7	1%	0.005	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	130.6	-176.5	-60	171.5	0	0	0	109.3	L48 I111 T123 I132 F133 V135	L48-I121 HydrophobicContact CD1-CB 4.5Å; L48-I121 HydrophobicContact CD1-CD1 3.74Å; L48-I121 HydrophobicContact CD1-CG1 3.82Å; L48-I121 HydrophobicContact CD1-CG2 3.91Å; L48-I121 HydrophobicContact CD2-CD1 3.48Å; L48-I121 VanDerWaalsContact CD2-CD1 3.48Å; L48-I121 HydrophobicContact CD2-CG1 4.44Å; L48-I121 HydrophobicContact CG-CD1 4.26Å; I111-I121 HydrophobicContact CD1-CG2 3.89Å; I111-I121 HydrophobicContact CG1-CG2 3.63Å; I121-T123 HydrophobicContact CG2-CG2 4.06Å; I121-I132 CarbonylContact O-C 3.52Å; I121-I132 VanDerWaalsContact O-CA 3.29Å; I121-I132 WeakPolarHBondContact O-CA 3.35Å; I121-F133 PolarHBondContact N-O 3.41Å; I121-F133 PolarHBondContact O-N 3.36Å; I121-V135 HydrophobicContact CD1-CB 4.32Å; I121-V135 HydrophobicContact CD1-CG1 3.69Å; I121-V135 HydrophobicContact CD1-CG2 3.63Å; I121-V135 HydrophobicContact CG1-CG2 4.25Å
122	A	95.4	Very high	92.5	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	135.6	165.6	0	0	0	0	0	110.6	I111 M112 F131 I132 L167 W169 I177	I111-A122 WeakPolarHBondContact CA-O 3.33Å; M112-A122 PolarHBondContact N-O 2.72Å; M112-A122 PolarHBondContact O-N 2.94Å; A122-F131 CarbonylContact C-O 3.6Å; A122-F131 WeakPolarHBondContact CA-O 3.23Å; A122-I132 HydrophobicContact CB-CD1 3.67Å; A122-L167 HydrophobicContact CB-CD2 4.11Å; A122-W169 HydrophobicContact CB-CH2 4.44Å; A122-W169 HydrophobicContact CB-CZ2 3.49Å; A122-W169 VanDerWaalsContact CB-CZ2 3.49Å; A122-I177 HydrophobicContact CB-CD1 3.32Å
123	T	93.8	Very high	92.6	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	143.3	172.7	62.3	0	0	0	0	110.8	V60 H104 Q110 I111 I121 L130 F131 F133	V60-T123 HydrophobicContact CG2-CG2 4.05Å; H104-T123 VanDerWaalsContact NE2-CB 3.3Å; H104-T123 WeakPolarHBondContact NE2-CB 3.38Å; H104-T123 PolarHBondContact NE2-OG1 3.47Å; Q110-T123 WeakPolarHBondContact O-CA 3.43Å; I111-T123 HydrophobicContact CB-CG2 4.31Å; I111-T123 HydrophobicContact CD1-CG2 3.82Å; I111-T123 HydrophobicContact CG1-CG2 3.89Å; I121-T123 HydrophobicContact CG2-CG2 4.06Å; T123-L130 WeakPolarHBondContact O-CA 2.81Å; T123-L130 WeakPolarHBondContact O-CB 2.99Å; T123-F131 PolarHBondContact N-O 2.85Å; T123-F131 PolarHBondContact O-N 3.13Å; T123-F131 WeakPolarHBondContact OG1-CB 3.39Å; T123-F131 PolarHBondContact OG1-O 3.22Å; T123-F133 HydrophobicContact CG2-CD2 4.21Å; T123-F133 HydrophobicContact CG2-CE2 4.14Å
124	K	91.4	Very high	92.6	Very high	5 Å²	5	27 Å²	27	2%	0.022	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	130.8	171.2	-174.8	168.6	-154	177	0	108.8	L109 Q110 L130 A164 G166 L167 T180	L109-K124 PolarHBondContact N-O 2.72Å; Q110-K124 HydrophobicContact CB-CB 4.24Å; Q110-K124 PolarHBondContact N-O 2.94Å; Q110-K124 PolarHBondContact O-N 2.77Å; K124-L130 HydrophobicContact CB-CD2 3.47Å; K124-L130 VanDerWaalsContact CB-CD2 3.47Å; K124-L130 HydrophobicContact CD-CD2 3.89Å; K124-L130 HydrophobicContact CG-CD2 3.44Å; K124-L130 VanDerWaalsContact CG-CD2 3.44Å; K124-A164 WeakPolarHBondContact CE-O 3.24Å; K124-A164 PolarHBondContact NZ-O 3.49Å; K124-G166 PolarHBondContact NZ-O 3.28Å; K124-L167 HydrophobicContact CB-CD2 4.15Å; K124-T180 PolarHBondContact NZ-O 3.28Å; K124-T180 PolarHBondContact NZ-OG1 3.41Å
125	S	89.4	Confident	92.4	Very high	5 Å²	5	26.8 Å²	26.8	4%	0.035	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	-176	172.4	59.3	0	0	0	0	112.3	E105 R107 G127	E105-S125 WeakPolarHBondContact O-CB 3.36Å; E105-S125 PolarHBondContact O-OG 3.24Å; R107-S125 WeakPolarHBondContact O-CA 3.36Å; R107-S125 WeakPolarHBondContact O-CB 3.41Å; S125-G127 PolarHBondContact O-N 3.04Å; S125-G127 PolarHBondContact OG-N 3.15Å
126	D	86.8	Confident	92.3	Very high	76 Å²	76	27.8 Å²	27.8	41%	0.406	15%	0.148	S	C	.	.	S	Bend	trans	-75.1	11.7	167.1	59.5	-6.2	0	0	0	113.7	G106 R107 A162	G106-D126 WeakPolarHBondContact CA-OD1 3.5Å; R107-D126 WeakPolarHBondContact CB-OD2 3.3Å; R107-D126 PolarHBondContact N-OD1 2.62Å; R107-D126 PolarHBondContact O-N 2.9Å; D126-A162 HydrophobicContact CB-CB 3.75Å; D126-A162 VanDerWaalsContact O-CB 3.31Å; D126-A162 WeakPolarHBondContact O-CB 3.22Å
127	G	88	Confident	92	Very high	23 Å²	23	25.9 Å²	25.9	24%	0.237	14%	0.14	C	C	.	.	S	Bend	trans	-92.8	-175.9	173.9	0	0	0	0	0	114.2	S125 Y129	S125-G127 PolarHBondContact O-N 3.04Å; S125-G127 PolarHBondContact OG-N 3.15Å; G127-Y129 VanDerWaalsContact C-N 3.31Å; G127-Y129 PolarHBondContact O-N 2.91Å
128	D	88	Confident	91.3	Very high	98 Å²	98	26.2 Å²	26.2	52%	0.524	15%	0.151	S	C	.	.	S	Bend	trans	-83.2	-6	-175.7	-61.8	-32.5	0	0	0	114.4	H160	D128-H160 CarbonylContact C-O 3.56Å; D128-H160 WeakPolarHBondContact CA-O 3.34Å; D128-H160 PolarHBondContact O-N 2.93Å; D128-H160 VanDerWaalsContact O-N 3.12Å
129	Y	91.7	Very high	90.6	Very high	76 Å²	76	30.9 Å²	30.9	30%	0.298	17%	0.17	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	147.2	-174.2	-61	-81.3	0	0	0	111.4	G127 R156 L157 I200	G127-Y129 VanDerWaalsContact C-N 3.31Å; G127-Y129 PolarHBondContact O-N 2.91Å; Y129-R156 HydrophobicContact CD1-CB 3.84Å; Y129-R156 HydrophobicContact CE1-CB 4.37Å; Y129-R156 HydrophobicContact CG-CB 4.23Å; Y129-L157 WeakPolarHBondContact CA-O 3.39Å; Y129-I200 HydrophobicContact CE1-CG2 4.49Å
130	L	93.4	Very high	89.9	Confident	0 Å²	0	37.2 Å²	37.2	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	147	151.4	-50.8	167.6	0	0	0	108.3	T123 K124 R156 L157 H160 L167	T123-L130 WeakPolarHBondContact O-CA 2.81Å; T123-L130 WeakPolarHBondContact O-CB 2.99Å; K124-L130 HydrophobicContact CB-CD2 3.47Å; K124-L130 VanDerWaalsContact CB-CD2 3.47Å; K124-L130 HydrophobicContact CD-CD2 3.89Å; K124-L130 HydrophobicContact CG-CD2 3.44Å; K124-L130 VanDerWaalsContact CG-CD2 3.44Å; L130-R156 WeakPolarHBondContact O-CA 3.25Å; L130-L157 HydrophobicContact CB-CB 4Å; L130-L157 HydrophobicContact CB-CD2 4.19Å; L130-L157 HydrophobicContact CD1-CB 4.47Å; L130-L157 HydrophobicContact CD1-CD2 4.01Å; L130-L157 PolarHBondContact N-O 3.25Å; L130-L157 PolarHBondContact O-N 3.33Å; L130-H160 WeakPolarHBondContact CD1-NE2 3.3Å; L130-H160 VanDerWaalsContact CG-CD2 3.47Å; L130-H160 WeakPolarHBondContact CG-CD2 3.41Å; L130-H160 WeakPolarHBondContact CG-NE2 3.37Å; L130-L167 HydrophobicContact CD1-CD1 3.72Å; L130-L167 HydrophobicContact CD2-CD1 4.12Å
131	F	95.2	Very high	89	Confident	4 Å²	4	39.8 Å²	39.8	2%	0.018	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	138.9	177	-56.6	-78.6	0	0	0	110.4	H104 E105 A122 T123 F133 P153 R156	H104-F131 AromaticContact CE1-CD2 3.6Å; H104-F131 AromaticContact CE1-CE2 3.94Å; H104-F131 AromaticContact NE2-CD2 3.57Å; E105-F131 HydrophobicContact CB-CE1 4.42Å; E105-F131 HydrophobicContact CB-CE2 3.84Å; E105-F131 HydrophobicContact CB-CZ 3.58Å; E105-F131 HydrophobicContact CG-CZ 4.3Å; E105-F131 WeakPolarHBondContact OE2-CZ 3.24Å; A122-F131 CarbonylContact C-O 3.6Å; A122-F131 WeakPolarHBondContact CA-O 3.23Å; T123-F131 PolarHBondContact N-O 2.85Å; T123-F131 PolarHBondContact O-N 3.13Å; T123-F131 WeakPolarHBondContact OG1-CB 3.39Å; T123-F131 PolarHBondContact OG1-O 3.22Å; F131-F133 HydrophobicContact CB-CD2 4.13Å; F131-F133 HydrophobicContact CB-CE2 3.39Å; F131-F133 HydrophobicContact CB-CZ 3.79Å; F131-F133 HydrophobicContact CG-CE2 4.31Å; F131-F133 HydrophobicContact CG-CZ 4.34Å; F131-P153 HydrophobicContact CB-CB 4.14Å; F131-P153 HydrophobicContact CD1-CB 3.9Å; F131-P153 HydrophobicContact CD1-CG 3.9Å; F131-P153 HydrophobicContact CE1-CG 4.5Å; F131-P153 HydrophobicContact CG-CB 4.47Å; F131-R156 HydrophobicContact CD1-CG 3.96Å; F131-R156 HydrophobicContact CE1-CG 3.97Å
132	I	96.6	Very high	88.1	Confident	0 Å²	0	40.5 Å²	40.5	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	124.6	169.9	-52.6	-59.8	0	0	0	107.4	I120 I121 A122 P153 M154 Y155 L157 W169 L191	I120-I132 HydrophobicContact CG2-CG2 3.51Å; I121-I132 CarbonylContact O-C 3.52Å; I121-I132 VanDerWaalsContact O-CA 3.29Å; I121-I132 WeakPolarHBondContact O-CA 3.35Å; A122-I132 HydrophobicContact CB-CD1 3.67Å; I132-P153 CarbonylContact O-C 3.09Å; I132-P153 WeakPolarHBondContact O-CA 3.29Å; I132-M154 WeakPolarHBondContact O-CB 3.41Å; I132-M154 PolarHBondContact O-N 3.34Å; I132-Y155 HydrophobicContact CB-CD2 4.36Å; I132-Y155 HydrophobicContact CG2-CD2 4.41Å; I132-Y155 PolarHBondContact N-O 2.89Å; I132-Y155 PolarHBondContact O-N 3.35Å; I132-L157 HydrophobicContact CD1-CD1 4.28Å; I132-L157 HydrophobicContact CD1-CD2 4.25Å; I132-L157 HydrophobicContact CG1-CD1 3.57Å; I132-L157 HydrophobicContact CG1-CD2 4.42Å; I132-W169 HydrophobicContact CD1-CH2 3.97Å; I132-W169 HydrophobicContact CD1-CZ2 4.11Å; I132-L191 HydrophobicContact CD1-CD1 4.38Å; I132-L191 HydrophobicContact CG1-CD1 4.14Å; I132-L191 HydrophobicContact CG1-CD2 4.04Å; I132-L191 HydrophobicContact CG2-CD1 3.96Å
133	F	96	Very high	87	Confident	4 Å²	4	47.7 Å²	47.7	2%	0.018	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	144	176.6	-63.5	-85.6	0	0	0	110.1	F102 H104 I120 I121 T123 F131 L151 P153	F102-F133 HydrophobicContact CD2-CD1 4.14Å; F102-F133 AromaticContact CD2-CE1 4Å; F102-F133 HydrophobicContact CD2-CE1 4Å; F102-F133 HydrophobicContact CD2-CZ 4.35Å; F102-F133 HydrophobicContact CE2-CB 4.4Å; F102-F133 AromaticContact CE2-CD1 3.63Å; F102-F133 HydrophobicContact CE2-CD1 3.63Å; F102-F133 AromaticContact CE2-CD2 3.84Å; F102-F133 HydrophobicContact CE2-CD2 3.84Å; F102-F133 AromaticContact CE2-CE1 3.72Å; F102-F133 HydrophobicContact CE2-CE1 3.72Å; F102-F133 AromaticContact CE2-CE2 3.91Å; F102-F133 HydrophobicContact CE2-CE2 3.91Å; F102-F133 AromaticContact CE2-CG 3.69Å; F102-F133 HydrophobicContact CE2-CG 3.69Å; F102-F133 AromaticContact CE2-CZ 3.86Å; F102-F133 HydrophobicContact CE2-CZ 3.86Å; F102-F133 HydrophobicContact CZ-CB 4.36Å; F102-F133 HydrophobicContact CZ-CD1 4.39Å; F102-F133 HydrophobicContact CZ-CD2 4.29Å; F102-F133 HydrophobicContact CZ-CG 4.1Å; H104-F133 AromaticContact CD2-CE2 3.8Å; H104-F133 AromaticContact CD2-CZ 3.99Å; I120-F133 WeakPolarHBondContact CA-O 3.33Å; I121-F133 PolarHBondContact N-O 3.41Å; I121-F133 PolarHBondContact O-N 3.36Å; T123-F133 HydrophobicContact CG2-CD2 4.21Å; T123-F133 HydrophobicContact CG2-CE2 4.14Å; F131-F133 HydrophobicContact CB-CD2 4.13Å; F131-F133 HydrophobicContact CB-CE2 3.39Å; F131-F133 HydrophobicContact CB-CZ 3.79Å; F131-F133 HydrophobicContact CG-CE2 4.31Å; F131-F133 HydrophobicContact CG-CZ 4.34Å; F133-L151 HydrophobicContact CB-CD2 4.23Å; F133-L151 HydrophobicContact CD1-CD2 4.11Å; F133-L151 HydrophobicContact CD1-CG 4.14Å; F133-P153 HydrophobicContact CD1-CB 4.17Å; F133-P153 HydrophobicContact CE1-CB 3.8Å; F133-P153 HydrophobicContact CE1-CG 4.42Å; F133-P153 HydrophobicContact CZ-CB 4.1Å
134	D	94	Very high	86.1	Confident	55 Å²	55	49.6 Å²	49.6	29%	0.294	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	117.2	162.6	-162.7	-12.1	0	0	0	108.7	T119 I120 N136 M154	T119-D134 PolarHBondContact OG1-OD1 2.93Å; I120-D134 HydrophobicContact CD1-CB 3.91Å; D134-N136 WeakPolarHBondContact OD1-CB 3.43Å; D134-N136 PolarHBondContact OD1-N 2.85Å; D134-M154 HydrophobicContact CB-CE 3.54Å
135	V	91.4	Very high	85.6	Confident	6 Å²	6	54 Å²	54	4%	0.036	30%	0.304	C	S	.	.			trans	-101.9	21.8	174.3	-58	0	0	0	0	111.9	L33 I62 F102 T119 I121 L137 L151	L33-V135 WeakPolarHBondContact CB-O 3.37Å; L33-V135 HydrophobicContact CD1-CB 4.15Å; L33-V135 WeakPolarHBondContact CD1-O 3.19Å; I62-V135 HydrophobicContact CD1-CB 4.01Å; I62-V135 HydrophobicContact CD1-CG1 4.08Å; I62-V135 HydrophobicContact CD1-CG2 3.95Å; F102-V135 HydrophobicContact CE1-CG1 4.02Å; F102-V135 HydrophobicContact CZ-CG1 4.33Å; T119-V135 WeakPolarHBondContact O-CG2 3.35Å; T119-V135 PolarHBondContact O-N 3.29Å; I121-V135 HydrophobicContact CD1-CB 4.32Å; I121-V135 HydrophobicContact CD1-CG1 3.69Å; I121-V135 HydrophobicContact CD1-CG2 3.63Å; I121-V135 HydrophobicContact CG1-CG2 4.25Å; V135-L137 PolarHBondContact O-N 2.83Å; V135-L151 HydrophobicContact CG1-CD2 3.82Å
136	N	89.5	Confident	85.4	Confident	84 Å²	84	57 Å²	57	45%	0.449	32%	0.319	S	S	.	.			trans	-74.8	71.6	167.3	-169.2	19.7	0	0	0	110.8	T119 D134	T119-N136 HydrophobicContact CG2-CB 3.98Å; D134-N136 WeakPolarHBondContact OD1-CB 3.43Å; D134-N136 PolarHBondContact OD1-N 2.85Å
137	L	86.6	Confident	85.5	Confident	19 Å²	19	55.9 Å²	55.9	10%	0.099	31%	0.311	C	S	.	.			trans	-89	154.8	-174.9	-53.5	174.6	0	0	0	112.2	L33 L100 V135 D141 L142 I149 L151	L33-L137 HydrophobicContact CD1-CB 4.42Å; L33-L137 HydrophobicContact CD1-CD1 3.89Å; L33-L137 HydrophobicContact CD1-CG 4.19Å; L100-L137 HydrophobicContact CD2-CD1 3.38Å; V135-L137 PolarHBondContact O-N 2.83Å; L137-D141 HydrophobicContact CB-CB 3.79Å; L137-D141 HydrophobicContact CD1-CB 4.24Å; L137-L142 HydrophobicContact CD1-CD2 4.46Å; L137-I149 HydrophobicContact CD1-CD1 3.19Å; L137-I149 HydrophobicContact CD2-CD1 4.18Å; L137-I149 HydrophobicContact CG-CD1 4.32Å; L137-L151 HydrophobicContact CD2-CD1 4.03Å
138	G	78.9	Confident	85.7	Confident	39 Å²	39	60.1 Å²	60.1	40%	0.402	32%	0.323	S	S	.	.			trans	-71.1	167.9	176.1	0	0	0	0	0	113	D140 D141 L142	G138-D140 PolarHBondContact O-N 2.87Å; G138-D141 PolarHBondContact N-OD2 2.83Å; G138-D141 PolarHBondContact O-N 3.11Å; G138-L142 WeakPolarHBondContact O-CG 3.4Å
139	E	75.8	Confident	85.9	Confident	133 Å²	133	56.5 Å²	56.5	62%	0.621	30%	0.303	S	S	*	.	H	α-helix	trans	-59.9	-36	175.9	-66.8	-177.9	172.6	0	0	111.8	D141 L142 E143	E139-D141 VanDerWaalsContact C-N 3.28Å; E139-D141 PolarHBondContact O-N 2.93Å; E139-L142 CarbonylContact O-C 3.6Å; E139-L142 PolarHBondContact O-N 3.27Å; E139-E143 PolarHBondContact O-N 3.2Å
140	D	76.4	Confident	85.9	Confident	137 Å²	137	59.5 Å²	59.5	73%	0.733	32%	0.324	S	S	*	.	H	α-helix	trans	-61.6	-34.8	178	-66.1	-22.6	0	0	0	112.2	G138 L142 K147	G138-D140 PolarHBondContact O-N 2.87Å; D140-L142 PolarHBondContact O-N 3.24Å; D140-K147 PolarHBondContact O-NZ 2.83Å
141	D	76	Confident	85.9	Confident	71 Å²	71	60.8 Å²	60.8	38%	0.38	33%	0.331	S	S	.	.	H	α-helix	trans	-75.1	-15.4	176.9	-62.4	-46.8	0	0	0	112.3	L137 G138 E139 K147	L137-D141 HydrophobicContact CB-CB 3.79Å; L137-D141 HydrophobicContact CD1-CB 4.24Å; G138-D141 PolarHBondContact N-OD2 2.83Å; G138-D141 PolarHBondContact O-N 3.11Å; E139-D141 VanDerWaalsContact C-N 3.28Å; E139-D141 PolarHBondContact O-N 2.93Å; D141-K147 WeakPolarHBondContact O-CD 3.4Å
142	L	75	Confident	85.9	Confident	15 Å²	15	68 Å²	68	8%	0.079	37%	0.365	C	S	.	.	H	α-helix	trans	-110.1	-4.6	-174.6	-61.5	173.2	0	0	0	114	L33 I99 L100 L137 G138 E139 D140 G144	L33-L142 HydrophobicContact CB-CD1 4.26Å; L33-L142 HydrophobicContact CD1-CD1 4.45Å; L33-L142 HydrophobicContact CD1-CD2 3.66Å; L33-L142 HydrophobicContact CG-CD1 3.89Å; L33-L142 HydrophobicContact CG-CD2 3.76Å; L33-L142 HydrophobicContact CG-CG 4.48Å; L33-L142 VanDerWaalsContact N-CD1 3.33Å; I99-L142 HydrophobicContact CG2-CD2 4.2Å; L100-L142 HydrophobicContact CD2-CD2 3.68Å; L137-L142 HydrophobicContact CD1-CD2 4.46Å; G138-L142 WeakPolarHBondContact O-CG 3.4Å; E139-L142 CarbonylContact O-C 3.6Å; E139-L142 PolarHBondContact O-N 3.27Å; D140-L142 PolarHBondContact O-N 3.24Å; L142-G144 PolarHBondContact O-N 3.46Å
143	E	72.9	Confident	85.8	Confident	152 Å²	152	68.8 Å²	68.8	71%	0.71	37%	0.37	S	S	*	.	S	Bend	trans	-65.6	97.6	-179.7	-168.5	-175	-167.7	0	0	113.3	E139 K147	E139-E143 PolarHBondContact O-N 3.2Å; E143-K147 WeakPolarHBondContact O-CE 3.44Å; E143-K147 PolarHBondContact O-NZ 2.87Å
144	G	76.1	Confident	85.8	Confident	39 Å²	39	71.8 Å²	71.8	40%	0.402	39%	0.385	S	S	.	.	S	Bend	trans	104.6	162.7	175.3	0	0	0	0	0	114.1	L142	L142-G144 PolarHBondContact O-N 3.46Å
145	P	80.8	Confident	85.9	Confident	98 Å²	98	71.8 Å²	71.8	64%	0.636	38%	0.381	S	S	*	.	S	Bend	trans	-80.8	153.7	-174.3	33	-35.3	0	0	0	112.8	K147	P145-K147 VanDerWaalsContact C-N 3.33Å; P145-K147 PolarHBondContact O-N 3.49Å
146	D	84.8	Confident	86	Confident	68 Å²	68	74.1 Å²	74.1	36%	0.364	39%	0.389	S	S	.	.	S	Bend	trans	54.5	40.8	172.4	-165.2	35.4	0	0	0	114.8	T98 I99 R101 F148	T98-D146 WeakPolarHBondContact CB-OD1 3.12Å; T98-D146 VanDerWaalsContact CG2-OD1 3.23Å; T98-D146 WeakPolarHBondContact CG2-OD1 3.4Å; T98-D146 WeakPolarHBondContact O-CA 3.21Å; T98-D146 PolarHBondContact O-N 2.81Å; I99-D146 PolarHBondContact O-N 2.94Å; R101-D146 IonicContact CZ-OD1 3.94Å; R101-D146 IonicContact CZ-OD2 2.96Å; R101-D146 IonicContact NE-OD1 3.68Å; R101-D146 PolarHBondContact NE-OD1 2.96Å; R101-D146 IonicContact NE-OD2 3.17Å; R101-D146 IonicContact NH2-OD1 3.3Å; R101-D146 PolarHBondContact NH2-OD1 2.8Å; R101-D146 IonicContact NH2-OD2 3.16Å; R101-D146 PolarHBondContact NH2-OD2 2.85Å; D146-F148 PolarHBondContact O-N 2.96Å
147	K	89	Confident	86.3	Confident	53 Å²	53	70.1 Å²	70.1	23%	0.23	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	131.3	177.4	-85.5	-171.6	156.4	166.1	0	111.7	I99 L100 R101 D140 D141 E143 P145 I149	I99-K147 PolarHBondContact O-N 2.81Å; L100-K147 CarbonylContact C-O 3.6Å; L100-K147 WeakPolarHBondContact CA-O 3.15Å; L100-K147 HydrophobicContact CB-CB 4.4Å; L100-K147 WeakPolarHBondContact CB-O 3.27Å; R101-K147 PolarHBondContact N-O 3.3Å; D140-K147 PolarHBondContact O-NZ 2.83Å; D141-K147 WeakPolarHBondContact O-CD 3.4Å; E143-K147 WeakPolarHBondContact O-CE 3.44Å; E143-K147 PolarHBondContact O-NZ 2.87Å; P145-K147 VanDerWaalsContact C-N 3.33Å; P145-K147 PolarHBondContact O-N 3.49Å; K147-I149 HydrophobicContact CB-CG2 4.37Å
148	F	91.1	Very high	86.4	Confident	111 Å²	111	70.8 Å²	70.8	49%	0.487	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	108.2	168.8	-163.2	-83.3	0	0	0	108.9	F59 R101 P103 D146	F59-F148 HydrophobicContact CB-CE2 4.36Å; R101-F148 HydrophobicContact CB-CD2 3.76Å; R101-F148 HydrophobicContact CB-CE2 4.26Å; R101-F148 CarbonylContact O-C 3.53Å; R101-F148 WeakPolarHBondContact O-CA 3.25Å; P103-F148 HydrophobicContact CB-CZ 4.15Å; P103-F148 HydrophobicContact CG-CE1 4.37Å; P103-F148 HydrophobicContact CG-CZ 4.45Å; D146-F148 PolarHBondContact O-N 2.96Å
149	I	92.1	Very high	86.4	Confident	22 Å²	22	71 Å²	71	11%	0.113	38%	0.376	C	S	.	.			trans	-104.5	147.2	-179	67.2	176.3	0	0	0	109.9	L100 R101 F102 P103 L137 K147 L151	L100-I149 HydrophobicContact CD1-CD1 4.16Å; L100-I149 HydrophobicContact CD2-CD1 4.15Å; R101-I149 PolarHBondContact O-N 3.36Å; F102-I149 WeakPolarHBondContact CA-O 3.49Å; F102-I149 HydrophobicContact CB-CG1 3.84Å; F102-I149 WeakPolarHBondContact CB-O 3.31Å; P103-I149 WeakPolarHBondContact CD-O 3.42Å; L137-I149 HydrophobicContact CD1-CD1 3.19Å; L137-I149 HydrophobicContact CD2-CD1 4.18Å; L137-I149 HydrophobicContact CG-CD1 4.32Å; K147-I149 HydrophobicContact CB-CG2 4.37Å; I149-L151 HydrophobicContact CD1-CB 4.08Å; I149-L151 HydrophobicContact CD1-CD2 4.46Å; I149-L151 HydrophobicContact CG1-CB 4.14Å; I149-L151 PolarHBondContact O-N 3.31Å
150	D	91.8	Very high	86.3	Confident	139 Å²	139	65 Å²	65	74%	0.743	35%	0.348	S	S	*	.			trans	-88.3	87	172	-168	16.1	0	0	0	108.9
151	L	94.4	Very high	85.7	Confident	27 Å²	27	62 Å²	62	14%	0.141	33%	0.332	C	S	.	.			trans	-100.1	110.4	-179.2	-174.3	64.3	0	0	0	110.1	F102 F133 V135 L137 I149	F102-L151 HydrophobicContact CB-CB 3.72Å; F102-L151 HydrophobicContact CD1-CD2 4.03Å; F102-L151 HydrophobicContact CD2-CB 4.2Å; F102-L151 HydrophobicContact CD2-CD2 4.21Å; F102-L151 HydrophobicContact CE1-CD2 4.1Å; F102-L151 HydrophobicContact CE2-CD2 4.28Å; F102-L151 HydrophobicContact CG-CB 3.95Å; F102-L151 HydrophobicContact CG-CD2 4.08Å; F102-L151 HydrophobicContact CZ-CD2 4.21Å; F133-L151 HydrophobicContact CB-CD2 4.23Å; F133-L151 HydrophobicContact CD1-CD2 4.11Å; F133-L151 HydrophobicContact CD1-CG 4.14Å; V135-L151 HydrophobicContact CG1-CD2 3.82Å; L137-L151 HydrophobicContact CD2-CD1 4.03Å; I149-L151 HydrophobicContact CD1-CB 4.08Å; I149-L151 HydrophobicContact CD1-CD2 4.46Å; I149-L151 HydrophobicContact CG1-CB 4.14Å; I149-L151 PolarHBondContact O-N 3.31Å
152	E	94.1	Very high	84.8	Confident	156 Å²	156	60.4 Å²	60.4	73%	0.729	33%	0.329	S	S	*	.			trans	-76.5	145.1	173.7	-66.4	-169.1	167.5	0	0	111.5	M154	E152-M154 PolarHBondContact O-N 3.46Å
153	P	95.3	Very high	84.3	Confident	17 Å²	17	67.1 Å²	67.1	11%	0.11	36%	0.36	C	S	.	.			trans	-66.8	132.1	175.5	27.4	-33.9	0	0	0	111	F131 I132 F133 Y155 R156	F131-P153 HydrophobicContact CB-CB 4.14Å; F131-P153 HydrophobicContact CD1-CB 3.9Å; F131-P153 HydrophobicContact CD1-CG 3.9Å; F131-P153 HydrophobicContact CE1-CG 4.5Å; F131-P153 HydrophobicContact CG-CB 4.47Å; I132-P153 CarbonylContact O-C 3.09Å; I132-P153 WeakPolarHBondContact O-CA 3.29Å; F133-P153 HydrophobicContact CD1-CB 4.17Å; F133-P153 HydrophobicContact CE1-CB 3.8Å; F133-P153 HydrophobicContact CE1-CG 4.42Å; F133-P153 HydrophobicContact CZ-CB 4.1Å; P153-Y155 VanDerWaalsContact C-N 3.32Å; P153-Y155 PolarHBondContact O-N 2.95Å; P153-R156 HydrophobicContact CG-CG 4.19Å
154	M	94.7	Very high	83.8	Confident	66 Å²	66	60.2 Å²	60.2	33%	0.325	33%	0.329	S	S	.	.	S	Bend	trans	-58.4	-45.7	171.3	-174.8	-166.1	-60.5	0	0	110.8	I120 I132 D134 E152 N199	I120-M154 HydrophobicContact CD1-CE 3.58Å; I132-M154 WeakPolarHBondContact O-CB 3.41Å; I132-M154 PolarHBondContact O-N 3.34Å; D134-M154 HydrophobicContact CB-CE 3.54Å; E152-M154 PolarHBondContact O-N 3.46Å; M154-N199 WeakPolarHBondContact O-CB 3.34Å
155	Y	96	Very high	83.9	Confident	56 Å²	56	59.9 Å²	59.9	22%	0.22	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	149.7	178.2	-60.6	-65.8	0	0	0	112.6	I132 P153 L191 A194 N199 V201	I132-Y155 HydrophobicContact CB-CD2 4.36Å; I132-Y155 HydrophobicContact CG2-CD2 4.41Å; I132-Y155 PolarHBondContact N-O 2.89Å; I132-Y155 PolarHBondContact O-N 3.35Å; P153-Y155 VanDerWaalsContact C-N 3.32Å; P153-Y155 PolarHBondContact O-N 2.95Å; Y155-L191 HydrophobicContact CD2-CD1 4.39Å; Y155-L191 HydrophobicContact CD2-CD2 3.96Å; Y155-L191 HydrophobicContact CE2-CB 4.48Å; Y155-L191 HydrophobicContact CG-CD2 4.44Å; Y155-A194 HydrophobicContact CD1-CB 4.41Å; Y155-A194 HydrophobicContact CE1-CB 3.87Å; Y155-N199 CarbonylContact C-O 3.56Å; Y155-N199 VanDerWaalsContact CA-O 3.26Å; Y155-N199 WeakPolarHBondContact CA-O 3.33Å; Y155-V201 HydrophobicContact CD1-CG2 3.72Å; Y155-V201 HydrophobicContact CE1-CG2 4.44Å; Y155-V201 HydrophobicContact CG-CG2 3.96Å
156	R	95.1	Very high	84.3	Confident	54 Å²	54	55.2 Å²	55.2	20%	0.204	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	110.5	172.5	-64.3	175.6	179.6	-101.9	-5.5	108.4	E105 Y129 L130 F131 P153 S158 N199 I200 V201	E105-R156 IonicContact OE1-CZ 2.87Å; E105-R156 VanDerWaalsContact OE1-CZ 3.22Å; E105-R156 IonicContact OE1-NH1 3.36Å; E105-R156 PolarHBondContact OE1-NH1 2.83Å; E105-R156 IonicContact OE1-NH2 2.72Å; E105-R156 PolarHBondContact OE1-NH2 2.9Å; E105-R156 IonicContact OE2-CZ 3.41Å; E105-R156 IonicContact OE2-NH1 3.92Å; E105-R156 PolarHBondContact OE2-NH1 3.48Å; Y129-R156 HydrophobicContact CD1-CB 3.84Å; Y129-R156 HydrophobicContact CE1-CB 4.37Å; Y129-R156 HydrophobicContact CG-CB 4.23Å; L130-R156 WeakPolarHBondContact O-CA 3.25Å; F131-R156 HydrophobicContact CD1-CG 3.96Å; F131-R156 HydrophobicContact CE1-CG 3.97Å; P153-R156 HydrophobicContact CG-CG 4.19Å; R156-S158 PolarHBondContact O-N 3.01Å; R156-N199 PolarHBondContact N-O 2.84Å; R156-I200 HydrophobicContact CB-CG1 4.49Å; R156-I200 CarbonylContact O-C 3.59Å; R156-I200 VanDerWaalsContact O-CA 3.24Å; R156-I200 WeakPolarHBondContact O-CA 3.46Å; R156-V201 PolarHBondContact O-N 3.18Å
157	L	94.4	Very high	84.8	Confident	0 Å²	0	52.1 Å²	52.1	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	108.5	-176	-76.7	52.2	0	0	0	108.2	Y129 L130 I132 I177 W189 L191 V201	Y129-L157 WeakPolarHBondContact CA-O 3.39Å; L130-L157 HydrophobicContact CB-CB 4Å; L130-L157 HydrophobicContact CB-CD2 4.19Å; L130-L157 HydrophobicContact CD1-CB 4.47Å; L130-L157 HydrophobicContact CD1-CD2 4.01Å; L130-L157 PolarHBondContact N-O 3.25Å; L130-L157 PolarHBondContact O-N 3.33Å; I132-L157 HydrophobicContact CD1-CD1 4.28Å; I132-L157 HydrophobicContact CD1-CD2 4.25Å; I132-L157 HydrophobicContact CG1-CD1 3.57Å; I132-L157 HydrophobicContact CG1-CD2 4.42Å; L157-I177 HydrophobicContact CD2-CG2 3.93Å; L157-W189 HydrophobicContact CB-CD2 3.93Å; L157-W189 HydrophobicContact CB-CE3 3.61Å; L157-W189 HydrophobicContact CB-CH2 4.3Å; L157-W189 HydrophobicContact CB-CZ3 3.77Å; L157-W189 HydrophobicContact CD2-CB 3.87Å; L157-W189 HydrophobicContact CD2-CD2 3.78Å; L157-W189 HydrophobicContact CD2-CE3 4.14Å; L157-W189 HydrophobicContact CD2-CG 3.6Å; L157-W189 HydrophobicContact CG-CB 4.42Å; L157-W189 HydrophobicContact CG-CD2 3.91Å; L157-W189 HydrophobicContact CG-CE3 3.73Å; L157-W189 HydrophobicContact CG-CG 4.19Å; L157-W189 HydrophobicContact CG-CZ3 4.38Å; L157-L191 HydrophobicContact CD1-CD2 4.15Å; L157-V201 CarbonylContact C-O 3.58Å; L157-V201 WeakPolarHBondContact CA-O 3.2Å; L157-V201 HydrophobicContact CD1-CB 4.18Å; L157-V201 HydrophobicContact CD1-CG2 4.41Å; L157-V201 HydrophobicContact CG-CB 4.23Å
158	S	89.7	Confident	85.1	Confident	34 Å²	34	50.9 Å²	50.9	24%	0.238	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	128.2	-170.2	62.6	0	0	0	0	112.9	R156 W189 V201	R156-S158 PolarHBondContact O-N 3.01Å; S158-W189 WeakPolarHBondContact O-CH2 3.32Å; S158-W189 WeakPolarHBondContact O-CZ3 3.32Å; S158-V201 PolarHBondContact N-O 3Å; S158-V201 PolarHBondContact OG-O 2.8Å
159	G	78.1	Confident	85.4	Confident	42 Å²	42	46 Å²	46	43%	0.433	26%	0.255	S	S	.	.	S	Bend	trans	131	24.4	175.9	0	0	0	0	0	114.1	S181	G159-S181 PolarHBondContact O-OG 3.43Å
160	H	74.4	Confident	85.7	Confident	9 Å²	9	45 Å²	45	4%	0.042	25%	0.249	C	C	.	.			trans	-110.3	159.5	177.6	-73.3	-77.5	0	0	0	111.4	D128 L130 S179 T180 S181 W189	D128-H160 CarbonylContact C-O 3.56Å; D128-H160 WeakPolarHBondContact CA-O 3.34Å; D128-H160 PolarHBondContact O-N 2.93Å; D128-H160 VanDerWaalsContact O-N 3.12Å; L130-H160 WeakPolarHBondContact CD1-NE2 3.3Å; L130-H160 VanDerWaalsContact CG-CD2 3.47Å; L130-H160 WeakPolarHBondContact CG-CD2 3.41Å; L130-H160 WeakPolarHBondContact CG-NE2 3.37Å; H160-S179 PolarHBondContact CE1-OG 3.29Å; H160-S179 PolarHBondContact NE2-OG 2.89Å; H160-T180 PolarHBondContact CE1-O 2.89Å; H160-T180 VanDerWaalsContact CE1-O 3.26Å; H160-T180 PolarHBondContact ND1-O 3.2Å; H160-S181 PolarHBondContact CE1-OG 2.86Å; H160-S181 VanDerWaalsContact CE1-OG 3.28Å; H160-W189 AromaticContact CD2-CH2 3.99Å; H160-W189 AromaticContact CD2-CZ2 3.61Å; H160-W189 AromaticContact CE1-CZ2 3.82Å; H160-W189 AromaticContact NE2-CE2 3.39Å; H160-W189 AromaticContact NE2-CH2 3.77Å; H160-W189 AromaticContact NE2-CZ2 2.92Å; H160-W189 WeakPolarHBondContact NE2-CZ2 3.19Å; H160-W189 AromaticContact NE2-NE1 3.51Å
161	N	63	Low	85.9	Confident	74 Å²	74	40.3 Å²	40.3	40%	0.396	23%	0.226	S	C	.	.			trans	-155.3	159.2	162.8	-165.7	-7.8	0	0	0	108.8	E163	N161-E163 PolarHBondContact O-N 3.44Å
162	A	58.6	Low	86.1	Confident	37 Å²	37	42.1 Å²	42.1	31%	0.306	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.7	12	-149	0	0	0	0	0	121.1	D126	D126-A162 HydrophobicContact CB-CB 3.75Å; D126-A162 VanDerWaalsContact O-CB 3.31Å; D126-A162 WeakPolarHBondContact O-CB 3.22Å
163	E	63	Low	86.2	Confident	155 Å²	155	37.6 Å²	37.6	72%	0.724	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	-102.4	-17.4	-167.8	-68.8	-165	155.5	0	0	116.1	N161	N161-E163 PolarHBondContact O-N 3.44Å
164	A	62.7	Low	86.3	Confident	8 Å²	8	42 Å²	42	7%	0.066	23%	0.234	C	C	.	.			trans	-118.5	135.7	-166.7	0	0	0	0	0	112.5	K124 T180 T213 V214	K124-A164 WeakPolarHBondContact CE-O 3.24Å; K124-A164 PolarHBondContact NZ-O 3.49Å; A164-T180 WeakPolarHBondContact CB-OG1 3.4Å; A164-T180 PolarHBondContact O-OG1 2.78Å; A164-T213 HydrophobicContact CB-CG2 4.03Å; A164-V214 WeakPolarHBondContact CB-O 3.38Å
165	G	77.9	Confident	86.3	Confident	31 Å²	31	39 Å²	39	32%	0.32	22%	0.22	S	C	.	.			trans	-80.6	-43.5	-172.2	0	0	0	0	0	114.4	Q110 L167	Q110-G165 PolarHBondContact OE1-O 3.34Å; G165-L167 PolarHBondContact O-N 3.11Å
166	G	90.1	Very high	86.4	Confident	0 Å²	0	37.4 Å²	37.4	0%	0	21%	0.214	C	C	.	.			trans	-47.8	126.4	-168.6	0	0	0	0	0	116.4	K124 S179 T180 R215	K124-G166 PolarHBondContact NZ-O 3.28Å; G166-S179 WeakPolarHBondContact O-CA 3.47Å; G166-T180 PolarHBondContact N-OG1 3.45Å; G166-T180 PolarHBondContact O-N 3.2Å; G166-T180 PolarHBondContact O-OG1 3.14Å; G166-R215 PolarHBondContact N-O 2.94Å
167	L	94.4	Very high	86.5	Confident	4 Å²	4	34.8 Å²	34.8	2%	0.021	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	131.2	171.7	-172.7	70.3	0	0	0	107.1	Q110 M112 A122 K124 L130 G165 I177 L178	Q110-L167 HydrophobicContact CB-CB 4.48Å; Q110-L167 HydrophobicContact CB-CD2 4.46Å; Q110-L167 HydrophobicContact CG-CB 4.16Å; Q110-L167 HydrophobicContact CG-CD2 4.35Å; Q110-L167 PolarHBondContact NE2-O 2.9Å; M112-L167 HydrophobicContact CE-CD2 4.46Å; M112-L167 HydrophobicContact CE-CG 4Å; M112-L167 HydrophobicContact CG-CD2 3.59Å; M112-L167 HydrophobicContact CG-CG 4.09Å; M112-L167 HydrophobicContact SD-CB 3.74Å; M112-L167 HydrophobicContact SD-CD2 3.71Å; M112-L167 HydrophobicContact SD-CG 3.56Å; M112-L167 VanDerWaalsContact SD-CG 3.56Å; A122-L167 HydrophobicContact CB-CD2 4.11Å; K124-L167 HydrophobicContact CB-CD2 4.15Å; L130-L167 HydrophobicContact CD1-CD1 3.72Å; L130-L167 HydrophobicContact CD2-CD1 4.12Å; G165-L167 PolarHBondContact O-N 3.11Å; L167-I177 HydrophobicContact CD1-CD1 3.46Å; L167-I177 VanDerWaalsContact CD1-CD1 3.46Å; L167-I177 HydrophobicContact CD1-CG1 3.89Å; L167-I177 HydrophobicContact CD2-CD1 4.47Å; L167-I177 HydrophobicContact CG-CD1 3.94Å; L167-I177 HydrophobicContact CG-CG1 4.48Å; L167-L178 CarbonylContact C-O 3.59Å; L167-L178 WeakPolarHBondContact CA-O 3.21Å
168	C	96.5	Very high	86.5	Confident	27 Å²	27	34.8 Å²	34.8	18%	0.182	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.5	122.3	-178.5	-169.1	0	0	0	0	111.2	M112 L178 V217 W219	M112-C168 VanDerWaalsContact CE-C 3.45Å; C168-L178 HydrophobicContact CB-CB 4.43Å; C168-L178 PolarHBondContact N-O 2.87Å; C168-L178 PolarHBondContact O-N 2.88Å; C168-V217 HydrophobicContact CB-CG2 4.15Å; C168-V217 WeakPolarHBondContact CB-O 3.32Å; C168-W219 VanDerWaalsContact O-CD1 3.25Å; C168-W219 PolarHBondContact O-NE1 2.81Å; C168-W219 PolarHBondContact SG-N 2.93Å; C168-W219 VanDerWaalsContact SG-N 3.39Å
169	W	97.8	Very high	86.8	Confident	9 Å²	9	33.2 Å²	33.2	3%	0.034	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	143	171.1	-75	111.5	0	0	0	109.3	M112 Y113 M114 P115 I120 A122 I132 P171 I177 L191 W219	M112-W169 HydrophobicContact CE-CB 4.2Å; M112-W169 HydrophobicContact CE-CG 3.88Å; M112-W169 PolarHBondContact O-NE1 2.75Å; M112-W169 VanDerWaalsContact O-NE1 3.11Å; Y113-W169 VanDerWaalsContact C-CD1 3.47Å; Y113-W169 PolarHBondContact O-NE1 2.98Å; M114-W169 HydrophobicContact CB-CD2 3.97Å; M114-W169 HydrophobicContact CB-CE3 4.24Å; M114-W169 HydrophobicContact CB-CG 4.43Å; M114-W169 HydrophobicContact CB-CH2 4.34Å; M114-W169 HydrophobicContact CB-CZ2 4.03Å; M114-W169 HydrophobicContact CB-CZ3 4.45Å; M114-W169 HydrophobicContact CE-CE3 4.26Å; M114-W169 HydrophobicContact CE-CH2 3.53Å; M114-W169 HydrophobicContact CE-CZ2 4.22Å; M114-W169 HydrophobicContact CE-CZ3 3.56Å; M114-W169 HydrophobicContact CG-CD2 4.03Å; M114-W169 HydrophobicContact CG-CE3 3.88Å; M114-W169 HydrophobicContact CG-CZ3 4.17Å; M114-W169 HydrophobicContact SD-CZ3 4.43Å; P115-W169 HydrophobicContact CG-CB 4.36Å; I120-W169 HydrophobicContact CG2-CH2 4.22Å; I120-W169 HydrophobicContact CG2-CZ2 4.24Å; A122-W169 HydrophobicContact CB-CH2 4.44Å; A122-W169 HydrophobicContact CB-CZ2 3.49Å; A122-W169 VanDerWaalsContact CB-CZ2 3.49Å; I132-W169 HydrophobicContact CD1-CH2 3.97Å; I132-W169 HydrophobicContact CD1-CZ2 4.11Å; W169-P171 VanDerWaalsContact O-CD 3.25Å; W169-P171 WeakPolarHBondContact O-CD 3.43Å; W169-I177 HydrophobicContact CD2-CB 4.2Å; W169-I177 HydrophobicContact CD2-CD1 3.96Å; W169-I177 HydrophobicContact CD2-CG1 4.25Å; W169-I177 HydrophobicContact CE3-CB 3.72Å; W169-I177 HydrophobicContact CE3-CD1 4.27Å; W169-I177 HydrophobicContact CE3-CG1 4.28Å; W169-I177 HydrophobicContact CG-CD1 4.48Å; W169-I177 HydrophobicContact CH2-CD1 4.35Å; W169-I177 HydrophobicContact CZ2-CD1 4.09Å; W169-I177 HydrophobicContact CZ3-CB 3.86Å; W169-I177 HydrophobicContact CZ3-CD1 4.42Å; W169-I177 HydrophobicContact CZ3-CG2 4.3Å; W169-L191 HydrophobicContact CH2-CD1 3.7Å; W169-L191 HydrophobicContact CZ3-CD1 4.04Å; W169-W219 VanDerWaalsContact C-CD1 3.42Å
170	N	98.1	Very high	87.4	Confident	0 Å²	0	31.2 Å²	31.2	0%	0	17%	0.173	C	C	.	.			trans	-76.6	113.1	170	-169	-24.9	0	0	0	108.5	Q116 N172 H173 Q176 W219 E224	Q116-N170 PolarHBondContact NE2-O 3.44Å; N170-N172 PolarHBondContact O-N 3.49Å; N170-N172 PolarHBondContact OD1-N 2.91Å; N170-H173 HydrophobicContact CB-CB 4.16Å; N170-H173 PolarHBondContact O-N 3.24Å; N170-H173 PolarHBondContact OD1-N 2.99Å; N170-Q176 HydrophobicContact CB-CB 4.03Å; N170-Q176 HydrophobicContact CB-CG 4.34Å; N170-Q176 PolarHBondContact N-O 2.83Å; N170-Q176 PolarHBondContact ND2-OE1 3.3Å; N170-W219 VanDerWaalsContact CA-CD1 3.46Å; N170-W219 HydrophobicContact CB-CD2 3.9Å; N170-W219 HydrophobicContact CB-CG 3.93Å; N170-W219 HydrophobicContact CB-CZ2 4.44Å; N170-E224 PolarHBondContact ND2-O 2.88Å
171	P	96.3	Very high	87.9	Confident	40 Å²	40	31.2 Å²	31.2	26%	0.26	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69	-15.1	-179.8	29.2	-33.9	0	0	0	112.7	P115 Q116 W169 L221	P115-P171 HydrophobicContact CG-CB 4.42Å; Q116-P171 PolarHBondContact NE2-O 3.05Å; W169-P171 VanDerWaalsContact O-CD 3.25Å; W169-P171 WeakPolarHBondContact O-CD 3.43Å; P171-L221 HydrophobicContact CG-CD2 4.17Å
172	N	97.3	Very high	88.4	Confident	65 Å²	65	34.1 Å²	34.1	35%	0.348	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	-106	-10.8	-176.4	-59.8	-62.4	0	0	0	113.6	N170 H220 L221 I222 E224	N170-N172 PolarHBondContact O-N 3.49Å; N170-N172 PolarHBondContact OD1-N 2.91Å; N172-H220 PolarHBondContact ND2-O 2.86Å; N172-L221 VanDerWaalsContact ND2-C 3.26Å; N172-L221 PolarHBondContact ND2-O 2.82Å; N172-L221 PolarHBondContact OD1-O 3.36Å; N172-I222 PolarHBondContact ND2-O 2.69Å; N172-E224 HydrophobicContact CB-CB 3.59Å
173	H	96.8	Very high	89.5	Confident	62 Å²	62	34.9 Å²	34.9	29%	0.287	20%	0.197	S	C	.	.	S	Bend	trans	-132.5	101.1	178.2	-169.4	-66.6	0	0	0	110.2	N170 G175 Q176 D190	N170-H173 HydrophobicContact CB-CB 4.16Å; N170-H173 PolarHBondContact O-N 3.24Å; N170-H173 PolarHBondContact OD1-N 2.99Å; H173-G175 PolarHBondContact O-N 2.86Å; H173-Q176 HydrophobicContact CB-CB 4.09Å; H173-Q176 WeakPolarHBondContact ND1-CB 3.34Å; H173-Q176 WeakPolarHBondContact O-CB 3.35Å; H173-Q176 PolarHBondContact O-N 2.86Å; H173-Q176 VanDerWaalsContact O-N 3.1Å; H173-D190 IonicContact CE1-OD2 2.73Å
174	E	96.9	Very high	90.8	Very high	108 Å²	108	31.5 Å²	31.5	51%	0.505	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.5	137.8	-178.4	-174.3	177.3	173.3	0	0	111.5	M114 Q116 Q176 N192	M114-E174 HydrophobicContact SD-CG 3.84Å; Q116-E174 HydrophobicContact CB-CB 4.36Å; Q116-E174 HydrophobicContact CB-CG 4.06Å; Q116-E174 HydrophobicContact CG-CB 4.24Å; Q116-E174 HydrophobicContact CG-CG 4.48Å; E174-Q176 PolarHBondContact O-N 2.88Å; E174-N192 PolarHBondContact O-ND2 2.98Å
175	G	96.3	Very high	92.2	Very high	3 Å²	3	31.9 Å²	31.9	3%	0.031	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	71.8	0.8	-179.6	0	0	0	0	0	115.3	M114 H173 L191	M114-G175 PolarHBondContact SD-N 2.95Å; M114-G175 VanDerWaalsContact SD-N 3.44Å; H173-G175 PolarHBondContact O-N 2.86Å; G175-L191 WeakPolarHBondContact O-CG 3.37Å; G175-L191 PolarHBondContact O-N 3.45Å
176	Q	97.2	Very high	92.9	Very high	23 Å²	23	30.4 Å²	30.4	11%	0.107	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	129.9	176.2	-172.9	177	85.9	0	0	111.6	N170 H173 E174 I188 W189 W219	N170-Q176 HydrophobicContact CB-CB 4.03Å; N170-Q176 HydrophobicContact CB-CG 4.34Å; N170-Q176 PolarHBondContact N-O 2.83Å; N170-Q176 PolarHBondContact ND2-OE1 3.3Å; H173-Q176 HydrophobicContact CB-CB 4.09Å; H173-Q176 WeakPolarHBondContact ND1-CB 3.34Å; H173-Q176 WeakPolarHBondContact O-CB 3.35Å; H173-Q176 PolarHBondContact O-N 2.86Å; H173-Q176 VanDerWaalsContact O-N 3.1Å; E174-Q176 PolarHBondContact O-N 2.88Å; Q176-I188 HydrophobicContact CG-CG2 3.66Å; Q176-W189 CarbonylContact C-O 3.54Å; Q176-W189 VanDerWaalsContact CA-O 3.27Å; Q176-W189 WeakPolarHBondContact CA-O 3.18Å; Q176-W189 WeakPolarHBondContact CG-O 3.35Å; Q176-W219 HydrophobicContact CG-CZ2 4.15Å; Q176-W219 VanDerWaalsContact OE1-CH2 3.27Å; Q176-W219 VanDerWaalsContact OE1-CZ2 3.31Å
177	I	96.6	Very high	93.1	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	141	-179	-172.1	166.9	0	0	0	111.1	A122 L157 L167 W169 I188 W189	A122-I177 HydrophobicContact CB-CD1 3.32Å; L157-I177 HydrophobicContact CD2-CG2 3.93Å; L167-I177 HydrophobicContact CD1-CD1 3.46Å; L167-I177 VanDerWaalsContact CD1-CD1 3.46Å; L167-I177 HydrophobicContact CD1-CG1 3.89Å; L167-I177 HydrophobicContact CD2-CD1 4.47Å; L167-I177 HydrophobicContact CG-CD1 3.94Å; L167-I177 HydrophobicContact CG-CG1 4.48Å; W169-I177 HydrophobicContact CD2-CB 4.2Å; W169-I177 HydrophobicContact CD2-CD1 3.96Å; W169-I177 HydrophobicContact CD2-CG1 4.25Å; W169-I177 HydrophobicContact CE3-CB 3.72Å; W169-I177 HydrophobicContact CE3-CD1 4.27Å; W169-I177 HydrophobicContact CE3-CG1 4.28Å; W169-I177 HydrophobicContact CG-CD1 4.48Å; W169-I177 HydrophobicContact CH2-CD1 4.35Å; W169-I177 HydrophobicContact CZ2-CD1 4.09Å; W169-I177 HydrophobicContact CZ3-CB 3.86Å; W169-I177 HydrophobicContact CZ3-CD1 4.42Å; W169-I177 HydrophobicContact CZ3-CG2 4.3Å; I177-I188 WeakPolarHBondContact O-CA 3.18Å; I177-W189 HydrophobicContact CG2-CB 3.67Å; I177-W189 HydrophobicContact CG2-CG 4.01Å; I177-W189 PolarHBondContact N-O 3.47Å; I177-W189 PolarHBondContact O-N 2.96Å
178	L	95.9	Very high	93.1	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	143.1	175.3	-175.4	71	0	0	0	109	L167 C168 V186 I188 V217 W219 F227	L167-L178 CarbonylContact C-O 3.59Å; L167-L178 WeakPolarHBondContact CA-O 3.21Å; C168-L178 HydrophobicContact CB-CB 4.43Å; C168-L178 PolarHBondContact N-O 2.87Å; C168-L178 PolarHBondContact O-N 2.88Å; L178-V186 HydrophobicContact CD1-CG1 3.35Å; L178-V186 HydrophobicContact CG-CG1 3.93Å; L178-I188 HydrophobicContact CD1-CG1 3.69Å; L178-V217 HydrophobicContact CB-CG2 4.39Å; L178-V217 HydrophobicContact CD2-CB 3.61Å; L178-V217 HydrophobicContact CD2-CG1 4.47Å; L178-V217 HydrophobicContact CD2-CG2 3.82Å; L178-V217 HydrophobicContact CG-CB 4.02Å; L178-V217 HydrophobicContact CG-CG2 3.81Å; L178-W219 HydrophobicContact CB-CZ2 4.19Å; L178-W219 HydrophobicContact CD1-CZ2 4.43Å; L178-F227 HydrophobicContact CD1-CD2 4.1Å; L178-F227 HydrophobicContact CD1-CE2 4Å; L178-F227 HydrophobicContact CD1-CG 4.47Å; L178-F227 HydrophobicContact CD1-CZ 4.31Å; L178-F227 HydrophobicContact CD2-CB 3.87Å; L178-F227 HydrophobicContact CD2-CD2 3.56Å; L178-F227 HydrophobicContact CD2-CE2 4.26Å; L178-F227 HydrophobicContact CD2-CG 3.84Å; L178-F227 HydrophobicContact CG-CD2 4.49Å
179	S	94.4	Very high	93	Very high	0 Å²	0	29 Å²	29	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.3	155.9	-177.3	60	0	0	0	0	111	H160 G166 V186 S187 W189	H160-S179 PolarHBondContact CE1-OG 3.29Å; H160-S179 PolarHBondContact NE2-OG 2.89Å; G166-S179 WeakPolarHBondContact O-CA 3.47Å; S179-V186 CarbonylContact O-C 3.56Å; S179-V186 WeakPolarHBondContact O-CA 3.49Å; S179-V186 WeakPolarHBondContact O-CG1 3.49Å; S179-S187 PolarHBondContact N-O 3.02Å; S179-S187 PolarHBondContact O-N 3.14Å; S179-S187 PolarHBondContact OG-O 2.94Å; S179-W189 PolarHBondContact OG-NE1 3.17Å
180	T	91.9	Very high	92.9	Very high	0 Å²	0	30 Å²	30	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	138.8	171.9	55.3	0	0	0	0	110.6	K124 H160 A164 G166 V186 V214 V217	K124-T180 PolarHBondContact NZ-O 3.28Å; K124-T180 PolarHBondContact NZ-OG1 3.41Å; H160-T180 PolarHBondContact CE1-O 2.89Å; H160-T180 VanDerWaalsContact CE1-O 3.26Å; H160-T180 PolarHBondContact ND1-O 3.2Å; A164-T180 WeakPolarHBondContact CB-OG1 3.4Å; A164-T180 PolarHBondContact O-OG1 2.78Å; G166-T180 PolarHBondContact N-OG1 3.45Å; G166-T180 PolarHBondContact O-N 3.2Å; G166-T180 PolarHBondContact O-OG1 3.14Å; T180-V186 HydrophobicContact CG2-CG2 4.46Å; T180-V214 HydrophobicContact CG2-CB 3.62Å; T180-V214 HydrophobicContact CG2-CG1 3.47Å; T180-V214 VanDerWaalsContact CG2-CG1 3.47Å; T180-V217 HydrophobicContact CG2-CG1 3.45Å; T180-V217 VanDerWaalsContact CG2-CG1 3.45Å
181	S	83.6	Confident	92.8	Very high	9 Å²	9	30.7 Å²	30.7	6%	0.063	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	176.2	-176.5	-64.1	0	0	0	0	110.7	G159 H160 S185 S187	G159-S181 PolarHBondContact O-OG 3.43Å; H160-S181 PolarHBondContact CE1-OG 2.86Å; H160-S181 VanDerWaalsContact CE1-OG 3.28Å; S181-S185 PolarHBondContact N-O 3.11Å; S181-S187 WeakPolarHBondContact OG-CB 3.32Å; S181-S187 PolarHBondContact OG-OG 2.85Å
182	E	74.6	Confident	92.6	Very high	136 Å²	136	34 Å²	34	64%	0.636	18%	0.182	S	C	*	.	G	3₁₀ helix	trans	-56.5	151.4	175.8	-168.1	-178.1	169.8	0	0	112.2	F184 S185	E182-F184 PolarHBondContact O-N 3.24Å; E182-S185 VanDerWaalsContact O-CB 3.28Å; E182-S185 WeakPolarHBondContact O-CB 3.3Å; E182-S185 PolarHBondContact O-OG 3.03Å
183	G	82.2	Confident	92.3	Very high	53 Å²	53	34 Å²	34	55%	0.546	19%	0.191	S	C	.	.	G	3₁₀ helix	trans	72.9	29.2	172.5	0	0	0	0	0	114.4	S185	G183-S185 PolarHBondContact O-N 3.01Å; G183-S185 PolarHBondContact O-OG 2.68Å
184	F	90.2	Very high	91.7	Very high	83 Å²	83	32 Å²	32	36%	0.364	19%	0.186	S	C	.	.	G	3₁₀ helix	trans	67.3	21.3	179	-39.4	-39.8	0	0	0	113.4	E182 H210 G212 T213 V214	E182-F184 PolarHBondContact O-N 3.24Å; F184-H210 HydrophobicContact CB-CB 4.16Å; F184-H210 WeakPolarHBondContact CB-O 3.43Å; F184-G212 VanDerWaalsContact CB-O 3.32Å; F184-G212 WeakPolarHBondContact CB-O 3.5Å; F184-G212 WeakPolarHBondContact CD1-O 3.39Å; F184-G212 WeakPolarHBondContact CG-O 3.39Å; F184-T213 VanDerWaalsContact CD1-N 3.32Å; F184-V214 WeakPolarHBondContact O-CG2 3.02Å
185	S	90.3	Very high	91	Very high	16 Å²	16	29.8 Å²	29.8	11%	0.112	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	152.5	-174.8	-48.4	0	0	0	0	110.9	S181 E182 G183 F207 N208	S181-S185 PolarHBondContact N-O 3.11Å; E182-S185 VanDerWaalsContact O-CB 3.28Å; E182-S185 WeakPolarHBondContact O-CB 3.3Å; E182-S185 PolarHBondContact O-OG 3.03Å; G183-S185 PolarHBondContact O-N 3.01Å; G183-S185 PolarHBondContact O-OG 2.68Å; S185-F207 WeakPolarHBondContact CA-O 3.28Å; S185-N208 WeakPolarHBondContact CB-OD1 3.34Å; S185-N208 PolarHBondContact OG-OD1 2.86Å
186	V	93.5	Very high	90.2	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	131.7	170.1	-178.5	0	0	0	0	108.5	L178 S179 T180 Q206 F207 V214 V217 F227 T229	L178-V186 HydrophobicContact CD1-CG1 3.35Å; L178-V186 HydrophobicContact CG-CG1 3.93Å; S179-V186 CarbonylContact O-C 3.56Å; S179-V186 WeakPolarHBondContact O-CA 3.49Å; S179-V186 WeakPolarHBondContact O-CG1 3.49Å; T180-V186 HydrophobicContact CG2-CG2 4.46Å; V186-Q206 CarbonylContact O-C 3.58Å; V186-Q206 WeakPolarHBondContact O-CA 3.45Å; V186-F207 HydrophobicContact CB-CB 4.37Å; V186-F207 PolarHBondContact N-O 3.25Å; V186-F207 WeakPolarHBondContact O-CD2 3.46Å; V186-F207 PolarHBondContact O-N 3.2Å; V186-V214 HydrophobicContact CG2-CB 4.32Å; V186-V214 HydrophobicContact CG2-CG1 3.9Å; V186-V214 HydrophobicContact CG2-CG2 4.02Å; V186-V217 HydrophobicContact CG1-CG1 4.14Å; V186-V217 HydrophobicContact CG2-CG1 4.27Å; V186-F227 HydrophobicContact CG1-CE2 4.25Å; V186-T229 HydrophobicContact CB-CG2 4.47Å; V186-T229 HydrophobicContact CG1-CG2 4.16Å; V186-T229 HydrophobicContact CG2-CG2 3.92Å
187	S	93.7	Very high	89.5	Confident	0 Å²	0	46 Å²	46	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	138.7	-176.2	-62.1	0	0	0	0	110.9	S179 S181 D205	S179-S187 PolarHBondContact N-O 3.02Å; S179-S187 PolarHBondContact O-N 3.14Å; S179-S187 PolarHBondContact OG-O 2.94Å; S181-S187 WeakPolarHBondContact OG-CB 3.32Å; S181-S187 PolarHBondContact OG-OG 2.85Å; S187-D205 WeakPolarHBondContact CA-O 3.2Å
188	I	94.7	Very high	89.1	Confident	2 Å²	2	48.1 Å²	48.1	1%	0.01	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	136.9	167.3	-63.4	172.8	0	0	0	108.4	Q176 I177 L178 P203 V204 D205 F207 W219 F227 V241	Q176-I188 HydrophobicContact CG-CG2 3.66Å; I177-I188 WeakPolarHBondContact O-CA 3.18Å; L178-I188 HydrophobicContact CD1-CG1 3.69Å; I188-P203 CarbonylContact O-C 3.46Å; I188-P203 WeakPolarHBondContact O-CA 3.43Å; I188-V204 HydrophobicContact CB-CG2 4.08Å; I188-V204 HydrophobicContact CG2-CG2 3.68Å; I188-V204 VanDerWaalsContact O-CG2 3.28Å; I188-V204 WeakPolarHBondContact O-CG2 3.47Å; I188-V204 PolarHBondContact O-N 2.84Å; I188-D205 HydrophobicContact CB-CB 4.34Å; I188-D205 HydrophobicContact CD1-CB 4.47Å; I188-D205 PolarHBondContact N-O 2.94Å; I188-F207 HydrophobicContact CD1-CE2 3.42Å; I188-F207 VanDerWaalsContact CD1-CE2 3.42Å; I188-F207 HydrophobicContact CD1-CZ 3.76Å; I188-F207 HydrophobicContact CG1-CE2 3.79Å; I188-W219 HydrophobicContact CD1-CH2 3.73Å; I188-W219 HydrophobicContact CD1-CZ2 3.95Å; I188-W219 HydrophobicContact CG1-CH2 4.33Å; I188-W219 HydrophobicContact CG1-CZ2 4.03Å; I188-W219 HydrophobicContact CG2-CZ2 4.34Å; I188-F227 HydrophobicContact CD1-CE1 4.11Å; I188-V241 HydrophobicContact CD1-CG1 3.43Å; I188-V241 VanDerWaalsContact CD1-CG1 3.43Å
189	W	95	Very high	88.9	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	143.8	174.7	-40.9	79.2	0	0	0	108.6	L157 S158 H160 Q176 I177 S179 V201 P203	L157-W189 HydrophobicContact CB-CD2 3.93Å; L157-W189 HydrophobicContact CB-CE3 3.61Å; L157-W189 HydrophobicContact CB-CH2 4.3Å; L157-W189 HydrophobicContact CB-CZ3 3.77Å; L157-W189 HydrophobicContact CD2-CB 3.87Å; L157-W189 HydrophobicContact CD2-CD2 3.78Å; L157-W189 HydrophobicContact CD2-CE3 4.14Å; L157-W189 HydrophobicContact CD2-CG 3.6Å; L157-W189 HydrophobicContact CG-CB 4.42Å; L157-W189 HydrophobicContact CG-CD2 3.91Å; L157-W189 HydrophobicContact CG-CE3 3.73Å; L157-W189 HydrophobicContact CG-CG 4.19Å; L157-W189 HydrophobicContact CG-CZ3 4.38Å; S158-W189 WeakPolarHBondContact O-CH2 3.32Å; S158-W189 WeakPolarHBondContact O-CZ3 3.32Å; H160-W189 AromaticContact CD2-CH2 3.99Å; H160-W189 AromaticContact CD2-CZ2 3.61Å; H160-W189 AromaticContact CE1-CZ2 3.82Å; H160-W189 AromaticContact NE2-CE2 3.39Å; H160-W189 AromaticContact NE2-CH2 3.77Å; H160-W189 AromaticContact NE2-CZ2 2.92Å; H160-W189 WeakPolarHBondContact NE2-CZ2 3.19Å; H160-W189 AromaticContact NE2-NE1 3.51Å; Q176-W189 CarbonylContact C-O 3.54Å; Q176-W189 VanDerWaalsContact CA-O 3.27Å; Q176-W189 WeakPolarHBondContact CA-O 3.18Å; Q176-W189 WeakPolarHBondContact CG-O 3.35Å; I177-W189 HydrophobicContact CG2-CB 3.67Å; I177-W189 HydrophobicContact CG2-CG 4.01Å; I177-W189 PolarHBondContact N-O 3.47Å; I177-W189 PolarHBondContact O-N 2.96Å; S179-W189 PolarHBondContact OG-NE1 3.17Å; W189-V201 HydrophobicContact CE3-CG1 4.43Å; W189-V201 VanDerWaalsContact CZ3-O 3.27Å; W189-V201 WeakPolarHBondContact CZ3-O 3.38Å; W189-P203 HydrophobicContact CD2-CB 4.18Å; W189-P203 HydrophobicContact CE3-CB 4.01Å; W189-P203 HydrophobicContact CH2-CB 3.81Å; W189-P203 HydrophobicContact CH2-CG 3.86Å; W189-P203 HydrophobicContact CZ2-CB 3.95Å; W189-P203 HydrophobicContact CZ2-CG 4.36Å; W189-P203 HydrophobicContact CZ3-CB 3.87Å; W189-P203 HydrophobicContact CZ3-CG 4.04Å
190	D	95.2	Very high	88.9	Confident	29 Å²	29	55.1 Å²	55.1	16%	0.155	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	110.1	174.1	-176.6	-2.6	0	0	0	108.2	H173 N192 A193 V204	H173-D190 IonicContact CE1-OD2 2.73Å; D190-N192 PolarHBondContact O-N 3.21Å; D190-N192 WeakPolarHBondContact OD1-CB 3.4Å; D190-N192 PolarHBondContact OD1-N 3.24Å; D190-N192 PolarHBondContact OD1-ND2 2.94Å; D190-A193 HydrophobicContact CB-CB 4.07Å; D190-A193 PolarHBondContact O-N 3.34Å; D190-A193 VanDerWaalsContact O-N 3.16Å; D190-V204 HydrophobicContact CB-CG1 3.96Å; D190-V204 HydrophobicContact CB-CG2 4.26Å
191	L	95.3	Very high	89	Confident	15 Å²	15	55.4 Å²	55.4	8%	0.079	31%	0.314	C	S	.	.	G	3₁₀ helix	trans	-66.7	-23.8	-179.9	-59.7	-174.4	0	0	0	112.1	M114 I132 Y155 L157 W169 G175 A193 A194	M114-L191 HydrophobicContact CE-CD1 4.26Å; I132-L191 HydrophobicContact CD1-CD1 4.38Å; I132-L191 HydrophobicContact CG1-CD1 4.14Å; I132-L191 HydrophobicContact CG1-CD2 4.04Å; I132-L191 HydrophobicContact CG2-CD1 3.96Å; Y155-L191 HydrophobicContact CD2-CD1 4.39Å; Y155-L191 HydrophobicContact CD2-CD2 3.96Å; Y155-L191 HydrophobicContact CE2-CB 4.48Å; Y155-L191 HydrophobicContact CG-CD2 4.44Å; L157-L191 HydrophobicContact CD1-CD2 4.15Å; W169-L191 HydrophobicContact CH2-CD1 3.7Å; W169-L191 HydrophobicContact CZ3-CD1 4.04Å; G175-L191 WeakPolarHBondContact O-CG 3.37Å; G175-L191 PolarHBondContact O-N 3.45Å; L191-A193 VanDerWaalsContact C-N 3.26Å; L191-A193 PolarHBondContact O-N 3.39Å; L191-A194 WeakPolarHBondContact O-CB 3.46Å; L191-A194 PolarHBondContact O-N 2.86Å
192	N	93.8	Very high	89.4	Confident	109 Å²	109	58.7 Å²	58.7	58%	0.583	34%	0.337	S	S	*	.	G	3₁₀ helix	trans	-74.6	-20.8	176.6	-51.1	-69.2	0	0	0	112.2	E174 D190 A194	E174-N192 PolarHBondContact O-ND2 2.98Å; D190-N192 PolarHBondContact O-N 3.21Å; D190-N192 WeakPolarHBondContact OD1-CB 3.4Å; D190-N192 PolarHBondContact OD1-N 3.24Å; D190-N192 PolarHBondContact OD1-ND2 2.94Å; N192-A194 VanDerWaalsContact C-N 3.32Å
193	A	89.7	Confident	90.3	Very high	65 Å²	65	53.9 Å²	53.9	54%	0.537	32%	0.317	S	S	.	.	G	3₁₀ helix	trans	-87.6	-1.8	174.1	0	0	0	0	0	112.8	D190 L191 V204	D190-A193 HydrophobicContact CB-CB 4.07Å; D190-A193 PolarHBondContact O-N 3.34Å; D190-A193 VanDerWaalsContact O-N 3.16Å; L191-A193 VanDerWaalsContact C-N 3.26Å; L191-A193 PolarHBondContact O-N 3.39Å; A193-V204 HydrophobicContact CB-CG1 4.28Å
194	A	85.5	Confident	90.8	Very high	21 Å²	21	54.4 Å²	54.4	17%	0.174	31%	0.31	C	S	.	.			trans	-62.7	142	-179.9	0	0	0	0	0	111.8	Y155 L191 N192 V201	Y155-A194 HydrophobicContact CD1-CB 4.41Å; Y155-A194 HydrophobicContact CE1-CB 3.87Å; L191-A194 WeakPolarHBondContact O-CB 3.46Å; L191-A194 PolarHBondContact O-N 2.86Å; N192-A194 VanDerWaalsContact C-N 3.32Å; A194-V201 HydrophobicContact CB-CG2 3.7Å
195	S	82.1	Confident	90.8	Very high	61 Å²	61	52.2 Å²	52.2	43%	0.427	30%	0.302	S	S	.	.			trans	-69.9	138.2	175.4	178.4	0	0	0	0	110.7	I197 S198	S195-I197 PolarHBondContact O-N 2.82Å; S195-I197 PolarHBondContact OG-N 2.95Å; S195-S198 VanDerWaalsContact O-O 3.07Å
196	Q	79.4	Confident	90.9	Very high	205 Å²	205	55.9 Å²	55.9	96%	0.958	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.2	-10.8	172.7	-65.4	-175.8	-2.7	0	0	113.5
197	I	81.7	Confident	90.9	Very high	162 Å²	162	56 Å²	56	83%	0.831	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.4	-26	-174.3	-55.9	172.4	0	0	0	111.7	S195	S195-I197 PolarHBondContact O-N 2.82Å; S195-I197 PolarHBondContact OG-N 2.95Å
198	S	89.1	Confident	90.8	Very high	45 Å²	45	60.6 Å²	60.6	32%	0.315	34%	0.342	S	S	.	.			trans	-133.8	130	-170.4	171.3	0	0	0	0	109.7	S195 I200	S195-S198 VanDerWaalsContact O-O 3.07Å; S198-I200 PolarHBondContact O-N 3.1Å; S198-I200 WeakPolarHBondContact OG-CB 3.27Å; S198-I200 PolarHBondContact OG-N 2.92Å; S198-I200 PolarHBondContact OG-O 2.7Å
199	N	92.1	Very high	90.7	Very high	74 Å²	74	61.9 Å²	61.9	40%	0.396	35%	0.352	S	S	.	.	S	Bend	trans	-74.6	-5.4	169.1	64.1	-16.7	0	0	0	112.5	M154 Y155 R156	M154-N199 WeakPolarHBondContact O-CB 3.34Å; Y155-N199 CarbonylContact C-O 3.56Å; Y155-N199 VanDerWaalsContact CA-O 3.26Å; Y155-N199 WeakPolarHBondContact CA-O 3.33Å; R156-N199 PolarHBondContact N-O 2.84Å
200	I	93.8	Very high	90.6	Very high	72 Å²	72	62.5 Å²	62.5	37%	0.369	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	122	172.7	-55.4	176.6	0	0	0	109.9	Y129 R156 S198	Y129-I200 HydrophobicContact CE1-CG2 4.49Å; R156-I200 HydrophobicContact CB-CG1 4.49Å; R156-I200 CarbonylContact O-C 3.59Å; R156-I200 VanDerWaalsContact O-CA 3.24Å; R156-I200 WeakPolarHBondContact O-CA 3.46Å; S198-I200 PolarHBondContact O-N 3.1Å; S198-I200 WeakPolarHBondContact OG-CB 3.27Å; S198-I200 PolarHBondContact OG-N 2.92Å; S198-I200 PolarHBondContact OG-O 2.7Å
201	V	94.2	Very high	90.6	Very high	6 Å²	6	69.7 Å²	69.7	4%	0.036	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	129.9	179.4	-177.3	0	0	0	0	109	Y155 R156 L157 S158 W189 A194	Y155-V201 HydrophobicContact CD1-CG2 3.72Å; Y155-V201 HydrophobicContact CE1-CG2 4.44Å; Y155-V201 HydrophobicContact CG-CG2 3.96Å; R156-V201 PolarHBondContact O-N 3.18Å; L157-V201 CarbonylContact C-O 3.58Å; L157-V201 WeakPolarHBondContact CA-O 3.2Å; L157-V201 HydrophobicContact CD1-CB 4.18Å; L157-V201 HydrophobicContact CD1-CG2 4.41Å; L157-V201 HydrophobicContact CG-CB 4.23Å; S158-V201 PolarHBondContact N-O 3Å; S158-V201 PolarHBondContact OG-O 2.8Å; W189-V201 HydrophobicContact CE3-CG1 4.43Å; W189-V201 VanDerWaalsContact CZ3-O 3.27Å; W189-V201 WeakPolarHBondContact CZ3-O 3.38Å; A194-V201 HydrophobicContact CB-CG2 3.7Å
202	S	92.3	Very high	90.5	Very high	79 Å²	79	69.5 Å²	69.5	55%	0.552	39%	0.386	S	S	*	.			trans	-93.8	155.5	172.7	60.9	0	0	0	0	110.8
203	P	92.5	Very high	90.4	Very high	34 Å²	34	65.4 Å²	65.4	22%	0.221	37%	0.365	C	S	.	.			trans	-67.6	142.1	-179.1	26.4	-29.8	0	0	0	110.6	I188 W189 Q206	I188-P203 CarbonylContact O-C 3.46Å; I188-P203 WeakPolarHBondContact O-CA 3.43Å; W189-P203 HydrophobicContact CD2-CB 4.18Å; W189-P203 HydrophobicContact CE3-CB 4.01Å; W189-P203 HydrophobicContact CH2-CB 3.81Å; W189-P203 HydrophobicContact CH2-CG 3.86Å; W189-P203 HydrophobicContact CZ2-CB 3.95Å; W189-P203 HydrophobicContact CZ2-CG 4.36Å; W189-P203 HydrophobicContact CZ3-CB 3.87Å; W189-P203 HydrophobicContact CZ3-CG 4.04Å; P203-Q206 HydrophobicContact CB-CG 4.15Å; P203-Q206 HydrophobicContact CG-CG 4.02Å; P203-Q206 VanDerWaalsContact CG-NE2 3.34Å
204	V	92.2	Very high	90.7	Very high	64 Å²	64	62.4 Å²	62.4	39%	0.388	34%	0.34	S	S	.	.	S	Bend	trans	-81.8	-30.3	176.9	-68	0	0	0	0	112.1	I188 D190 A193	I188-V204 HydrophobicContact CB-CG2 4.08Å; I188-V204 HydrophobicContact CG2-CG2 3.68Å; I188-V204 VanDerWaalsContact O-CG2 3.28Å; I188-V204 WeakPolarHBondContact O-CG2 3.47Å; I188-V204 PolarHBondContact O-N 2.84Å; D190-V204 HydrophobicContact CB-CG1 3.96Å; D190-V204 HydrophobicContact CB-CG2 4.26Å; A193-V204 HydrophobicContact CB-CG1 4.28Å
205	D	91.8	Very high	91.1	Very high	37 Å²	37	65.6 Å²	65.6	20%	0.198	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	150	176.9	-85.4	-51.1	0	0	0	110.1	S187 I188 F207 R246	S187-D205 WeakPolarHBondContact CA-O 3.2Å; I188-D205 HydrophobicContact CB-CB 4.34Å; I188-D205 HydrophobicContact CD1-CB 4.47Å; I188-D205 PolarHBondContact N-O 2.94Å; D205-F207 HydrophobicContact CB-CE2 3.97Å; D205-F207 HydrophobicContact CB-CZ 4.1Å; D205-R246 WeakPolarHBondContact OD1-CD 3.23Å; D205-R246 IonicContact OD1-CZ 2.69Å; D205-R246 IonicContact OD1-NE 2.68Å; D205-R246 PolarHBondContact OD1-NE 3.31Å; D205-R246 VanDerWaalsContact OD1-NE 3.16Å; D205-R246 IonicContact OD1-NH1 3.83Å; D205-R246 PolarHBondContact OD1-NH1 2.8Å; D205-R246 IonicContact OD1-NH2 2.84Å; D205-R246 IonicContact OD2-CZ 2.85Å; D205-R246 IonicContact OD2-NE 3.89Å; D205-R246 PolarHBondContact OD2-NE 3.37Å; D205-R246 IonicContact OD2-NH1 2.69Å; D205-R246 IonicContact OD2-NH2 3.48Å; D205-R246 PolarHBondContact OD2-NH2 2.95Å
206	Q	91.3	Very high	91.7	Very high	93 Å²	93	63 Å²	63	44%	0.435	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	140	176.7	-69.4	-173.3	-26.6	0	0	111.1	V186 P203	V186-Q206 CarbonylContact O-C 3.58Å; V186-Q206 WeakPolarHBondContact O-CA 3.45Å; P203-Q206 HydrophobicContact CB-CG 4.15Å; P203-Q206 HydrophobicContact CG-CG 4.02Å; P203-Q206 VanDerWaalsContact CG-NE2 3.34Å
207	F	93.2	Very high	92.5	Very high	2 Å²	2	53.4 Å²	53.4	1%	0.009	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	116.5	-174.9	-54.6	-92	0	0	0	110.5	S185 V186 I188 D205 F227 W239 V241 R246	S185-F207 WeakPolarHBondContact CA-O 3.28Å; V186-F207 HydrophobicContact CB-CB 4.37Å; V186-F207 PolarHBondContact N-O 3.25Å; V186-F207 WeakPolarHBondContact O-CD2 3.46Å; V186-F207 PolarHBondContact O-N 3.2Å; I188-F207 HydrophobicContact CD1-CE2 3.42Å; I188-F207 VanDerWaalsContact CD1-CE2 3.42Å; I188-F207 HydrophobicContact CD1-CZ 3.76Å; I188-F207 HydrophobicContact CG1-CE2 3.79Å; D205-F207 HydrophobicContact CB-CE2 3.97Å; D205-F207 HydrophobicContact CB-CZ 4.1Å; F207-F227 HydrophobicContact CD1-CZ 4.27Å; F207-F227 AromaticContact CD2-CZ 3.82Å; F207-F227 HydrophobicContact CD2-CZ 3.82Å; F207-F227 HydrophobicContact CE1-CE1 4.44Å; F207-F227 HydrophobicContact CE1-CZ 4.16Å; F207-F227 HydrophobicContact CE2-CE1 4.16Å; F207-F227 AromaticContact CE2-CZ 3.75Å; F207-F227 HydrophobicContact CE2-CZ 3.75Å; F207-F227 HydrophobicContact CG-CZ 4.1Å; F207-F227 HydrophobicContact CZ-CE1 4.03Å; F207-F227 AromaticContact CZ-CZ 3.91Å; F207-F227 HydrophobicContact CZ-CZ 3.91Å; F207-W239 HydrophobicContact CB-CE3 4.37Å; F207-W239 HydrophobicContact CB-CH2 3.82Å; F207-W239 HydrophobicContact CB-CZ2 4.02Å; F207-W239 HydrophobicContact CB-CZ3 4.02Å; F207-W239 HydrophobicContact CD1-CD2 4.14Å; F207-W239 AromaticContact CD1-CE3 3.5Å; F207-W239 HydrophobicContact CD1-CE3 3.5Å; F207-W239 HydrophobicContact CD1-CH2 4.3Å; F207-W239 AromaticContact CD1-CZ3 3.61Å; F207-W239 HydrophobicContact CD1-CZ3 3.61Å; F207-W239 HydrophobicContact CE1-CE3 4.17Å; F207-W239 HydrophobicContact CG-CE3 4.22Å; F207-W239 HydrophobicContact CG-CZ3 4.24Å; F207-V241 HydrophobicContact CZ-CG1 4.22Å; F207-R246 HydrophobicContact CD1-CB 4.1Å; F207-R246 HydrophobicContact CE1-CB 3.86Å; F207-R246 HydrophobicContact CE1-CG 3.9Å
208	N	91.3	Very high	93.3	Very high	97 Å²	97	46.1 Å²	46.1	52%	0.519	25%	0.248	S	C	.	.			trans	-125.6	71.5	-169.4	-55.2	-25.9	0	0	0	110.2	S185	S185-N208 WeakPolarHBondContact CB-OD1 3.34Å; S185-N208 PolarHBondContact OG-OD1 2.86Å
209	S	92.6	Very high	93.7	Very high	30 Å²	30	44 Å²	44	21%	0.21	23%	0.233	C	C	.	.			trans	-116.8	-32.6	179.8	179	0	0	0	0	113.3	H237 W239 P249	S209-H237 PolarHBondContact OG-CD2 3.03Å; S209-H237 PolarHBondContact OG-NE2 2.97Å; S209-W239 VanDerWaalsContact CB-CH2 3.47Å; S209-P249 WeakPolarHBondContact OG-CD 3.39Å
210	H	93.9	Very high	94	Very high	12 Å²	12	40.7 Å²	40.7	6%	0.056	22%	0.215	C	C	.	.			trans	-63.7	149.7	178.9	-79.2	-67.4	0	0	0	111.9	F184 V214 T229 A231 D233 R235 H237	F184-H210 HydrophobicContact CB-CB 4.16Å; F184-H210 WeakPolarHBondContact CB-O 3.43Å; H210-V214 HydrophobicContact CB-CG2 3.85Å; H210-T229 PolarHBondContact CD2-OG1 3.23Å; H210-T229 PolarHBondContact NE2-OG1 3.39Å; H210-A231 HydrophobicContact CB-CB 4.23Å; H210-A231 WeakPolarHBondContact ND1-CB 3.49Å; H210-D233 VanDerWaalsContact CA-OD2 3.31Å; H210-D233 WeakPolarHBondContact CA-OD2 3.32Å; H210-D233 WeakPolarHBondContact CB-OD2 3.16Å; H210-D233 IonicContact CE1-OD1 3.29Å; H210-D233 IonicContact CG-OD2 3.61Å; H210-D233 IonicContact ND1-OD1 3.3Å; H210-D233 PolarHBondContact ND1-OD1 2.82Å; H210-D233 IonicContact ND1-OD2 2.96Å; H210-D233 PolarHBondContact ND1-OD2 3.41Å; H210-R235 PolarHBondContact CE1-O 3.32Å; H210-H237 AromaticContact CD2-CD2 3.82Å; H210-H237 AromaticContact CE1-CD2 3.6Å; H210-H237 AromaticContact CE1-CG 3.69Å; H210-H237 AromaticContact CE1-NE2 3.94Å; H210-H237 AromaticContact ND1-CD2 3.9Å; H210-H237 AromaticContact ND1-NE2 3.87Å; H210-H237 AromaticContact NE2-CD2 3.55Å; H210-H237 AromaticContact NE2-CG 3.73Å
211	K	94.4	Very high	94.2	Very high	181 Å²	181	40.5 Å²	40.5	79%	0.787	22%	0.215	S	C	*	.	S	Bend	trans	-110.5	8.3	-179.8	-62.3	179.2	-176.5	170.1	0	112.9	D233	K211-D233 HydrophobicContact CB-CB 4.23Å; K211-D233 PolarHBondContact N-OD2 3.24Å
212	G	93.3	Very high	94.3	Very high	10 Å²	10	44.9 Å²	44.9	10%	0.103	24%	0.237	C	C	.	.	S	Bend	trans	-152	170.1	176.9	0	0	0	0	0	110.3	F184 V214	F184-G212 VanDerWaalsContact CB-O 3.32Å; F184-G212 WeakPolarHBondContact CB-O 3.5Å; F184-G212 WeakPolarHBondContact CD1-O 3.39Å; F184-G212 WeakPolarHBondContact CG-O 3.39Å; G212-V214 PolarHBondContact O-N 3.38Å; G212-V214 VanDerWaalsContact O-N 3.16Å
213	T	92.9	Very high	94.5	Very high	24 Å²	24	44.4 Å²	44.4	15%	0.147	23%	0.226	C	C	.	.			trans	-55.7	121.1	-175.7	-57.4	0	0	0	0	111	A164 F184 R215 A231 D232	A164-T213 HydrophobicContact CB-CG2 4.03Å; F184-T213 VanDerWaalsContact CD1-N 3.32Å; T213-R215 PolarHBondContact O-N 2.77Å; T213-A231 CarbonylContact O-C 3.6Å; T213-A231 VanDerWaalsContact O-CA 3.29Å; T213-A231 WeakPolarHBondContact O-CA 3.44Å; T213-A231 WeakPolarHBondContact O-CB 3.42Å; T213-D232 PolarHBondContact O-N 3.36Å
214	V	94.7	Very high	94.7	Very high	2 Å²	2	47.6 Å²	47.6	1%	0.012	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	114.7	175.9	-171.2	0	0	0	0	107.9	A164 T180 F184 V186 H210 G212 V217 V230 A231	A164-V214 WeakPolarHBondContact CB-O 3.38Å; T180-V214 HydrophobicContact CG2-CB 3.62Å; T180-V214 HydrophobicContact CG2-CG1 3.47Å; T180-V214 VanDerWaalsContact CG2-CG1 3.47Å; F184-V214 WeakPolarHBondContact O-CG2 3.02Å; V186-V214 HydrophobicContact CG2-CB 4.32Å; V186-V214 HydrophobicContact CG2-CG1 3.9Å; V186-V214 HydrophobicContact CG2-CG2 4.02Å; H210-V214 HydrophobicContact CB-CG2 3.85Å; G212-V214 PolarHBondContact O-N 3.38Å; G212-V214 VanDerWaalsContact O-N 3.16Å; V214-V217 HydrophobicContact CG1-CG1 3.93Å; V214-V230 CarbonylContact C-O 3.59Å; V214-V230 WeakPolarHBondContact CG1-O 3.27Å; V214-A231 HydrophobicContact CB-CB 4.43Å; V214-A231 HydrophobicContact CG2-CB 4.28Å
215	R	94	Very high	94.8	Very high	87 Å²	87	45.5 Å²	45.5	33%	0.328	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	-45.4	-172.7	-69.7	-67.2	179.6	-178.7	-4.5	111.6	G166 T213 V230 D232 I260	G166-R215 PolarHBondContact N-O 2.94Å; T213-R215 PolarHBondContact O-N 2.77Å; R215-V230 PolarHBondContact N-O 2.83Å; R215-D232 WeakPolarHBondContact CG-OD1 3.25Å; R215-D232 IonicContact CZ-OD1 3.8Å; R215-D232 IonicContact CZ-OD2 2.89Å; R215-D232 VanDerWaalsContact NE-CG 3.32Å; R215-D232 IonicContact NE-OD1 2.94Å; R215-D232 PolarHBondContact NE-OD1 2.82Å; R215-D232 IonicContact NE-OD2 3.26Å; R215-D232 PolarHBondContact NE-OD2 3.08Å; R215-D232 IonicContact NH2-OD1 3.24Å; R215-D232 PolarHBondContact NH2-OD1 3.48Å; R215-D232 IonicContact NH2-OD2 3.4Å; R215-D232 PolarHBondContact NH2-OD2 2.84Å; R215-I260 VanDerWaalsContact CB-O 3.23Å; R215-I260 WeakPolarHBondContact CB-O 3.06Å; R215-I260 VanDerWaalsContact CG-O 3.27Å; R215-I260 WeakPolarHBondContact CG-O 3.04Å
216	D	95.4	Very high	95.1	Very high	7 Å²	7	45.4 Å²	45.4	4%	0.037	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	156.2	-176.2	-153.5	4.5	0	0	0	111.8	V230 C262 V263 K306	D216-V230 HydrophobicContact CB-CG2 3.8Å; D216-V230 PolarHBondContact N-O 3.49Å; D216-V230 PolarHBondContact O-N 3.37Å; D216-C262 WeakPolarHBondContact OD2-CA 3.19Å; D216-C262 WeakPolarHBondContact OD2-CB 3.37Å; D216-V263 HydrophobicContact CB-CG1 4.26Å; D216-V263 PolarHBondContact OD2-N 2.83Å; D216-K306 IonicContact OD1-NZ 3.24Å; D216-K306 PolarHBondContact OD1-NZ 2.94Å; D216-K306 IonicContact OD2-NZ 3.37Å; D216-K306 PolarHBondContact OD2-NZ 3.2Å
217	V	96.5	Very high	95.4	Very high	3 Å²	3	41 Å²	41	2%	0.018	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	140.6	-178.6	-59.3	0	0	0	0	109	C168 L178 T180 V186 V214 V228 T229	C168-V217 HydrophobicContact CB-CG2 4.15Å; C168-V217 WeakPolarHBondContact CB-O 3.32Å; L178-V217 HydrophobicContact CB-CG2 4.39Å; L178-V217 HydrophobicContact CD2-CB 3.61Å; L178-V217 HydrophobicContact CD2-CG1 4.47Å; L178-V217 HydrophobicContact CD2-CG2 3.82Å; L178-V217 HydrophobicContact CG-CB 4.02Å; L178-V217 HydrophobicContact CG-CG2 3.81Å; T180-V217 HydrophobicContact CG2-CG1 3.45Å; T180-V217 VanDerWaalsContact CG2-CG1 3.45Å; V186-V217 HydrophobicContact CG1-CG1 4.14Å; V186-V217 HydrophobicContact CG2-CG1 4.27Å; V214-V217 HydrophobicContact CG1-CG1 3.93Å; V217-V228 WeakPolarHBondContact CA-O 3.39Å; V217-T229 HydrophobicContact CB-CG2 4.39Å; V217-T229 HydrophobicContact CG1-CG2 3.82Å
218	A	97.8	Very high	95.7	Very high	9 Å²	9	41 Å²	41	7%	0.074	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	125	178.5	0	0	0	0	0	110.6	F227 V228 V263 F265	A218-F227 CarbonylContact O-C 3.1Å; A218-F227 VanDerWaalsContact O-CA 3.23Å; A218-F227 WeakPolarHBondContact O-CA 3.35Å; A218-F227 VanDerWaalsContact O-CB 3.28Å; A218-F227 WeakPolarHBondContact O-CB 3.48Å; A218-V228 PolarHBondContact N-O 3.29Å; A218-V228 PolarHBondContact O-N 2.93Å; A218-V263 HydrophobicContact CB-CG1 3.92Å; A218-F265 HydrophobicContact CB-CD2 3.89Å; A218-F265 HydrophobicContact CB-CE2 4.13Å; A218-F265 WeakPolarHBondContact O-CE2 3.23Å
219	W	98.4	Very high	95.9	Very high	2 Å²	2	36.3 Å²	36.3	1%	0.008	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.6	145.7	162.4	-78	108.2	0	0	0	110.2	C168 W169 N170 Q176 L178 I188 E224 F227 V241 F265	C168-W219 VanDerWaalsContact O-CD1 3.25Å; C168-W219 PolarHBondContact O-NE1 2.81Å; C168-W219 PolarHBondContact SG-N 2.93Å; C168-W219 VanDerWaalsContact SG-N 3.39Å; W169-W219 VanDerWaalsContact C-CD1 3.42Å; N170-W219 VanDerWaalsContact CA-CD1 3.46Å; N170-W219 HydrophobicContact CB-CD2 3.9Å; N170-W219 HydrophobicContact CB-CG 3.93Å; N170-W219 HydrophobicContact CB-CZ2 4.44Å; Q176-W219 HydrophobicContact CG-CZ2 4.15Å; Q176-W219 VanDerWaalsContact OE1-CH2 3.27Å; Q176-W219 VanDerWaalsContact OE1-CZ2 3.31Å; L178-W219 HydrophobicContact CB-CZ2 4.19Å; L178-W219 HydrophobicContact CD1-CZ2 4.43Å; I188-W219 HydrophobicContact CD1-CH2 3.73Å; I188-W219 HydrophobicContact CD1-CZ2 3.95Å; I188-W219 HydrophobicContact CG1-CH2 4.33Å; I188-W219 HydrophobicContact CG1-CZ2 4.03Å; I188-W219 HydrophobicContact CG2-CZ2 4.34Å; W219-E224 WeakPolarHBondContact CZ3-O 3.12Å; W219-F227 HydrophobicContact CD2-CB 4.11Å; W219-F227 HydrophobicContact CE3-CB 3.77Å; W219-F227 HydrophobicContact CE3-CD1 4.23Å; W219-F227 HydrophobicContact CE3-CG 4.42Å; W219-F227 AromaticContact CH2-CD1 3.97Å; W219-F227 HydrophobicContact CH2-CD1 3.97Å; W219-F227 HydrophobicContact CZ3-CB 4.17Å; W219-F227 AromaticContact CZ3-CD1 3.74Å; W219-F227 HydrophobicContact CZ3-CD1 3.74Å; W219-F227 HydrophobicContact CZ3-CG 4.36Å; W219-V241 HydrophobicContact CH2-CG1 3.89Å; W219-V241 HydrophobicContact CZ3-CG1 4.22Å; W219-F265 WeakPolarHBondContact O-CD2 3.42Å
220	H	98.2	Very high	96.2	Very high	3 Å²	3	34.9 Å²	34.9	1%	0.014	17%	0.169	C	C	.	.			trans	-67.4	139.4	169.5	-170.6	-70.1	0	0	0	110.1	N172 I222 H223 L226 F265 E270	N172-H220 PolarHBondContact ND2-O 2.86Å; H220-I222 PolarHBondContact ND1-N 3.04Å; H220-I222 PolarHBondContact O-N 3.48Å; H220-H223 HydrophobicContact CB-CB 4.41Å; H220-H223 AromaticContact CE1-CD2 3.39Å; H220-H223 PolarHBondContact CE1-CD2 2.91Å; H220-H223 AromaticContact ND1-CD2 3.73Å; H220-H223 PolarHBondContact ND1-N 2.85Å; H220-H223 AromaticContact NE2-CD2 3.71Å; H220-L226 HydrophobicContact CB-CB 3.81Å; H220-L226 WeakPolarHBondContact CB-O 3.08Å; H220-L226 PolarHBondContact N-O 2.84Å; H220-F265 HydrophobicContact CB-CE2 4.19Å; H220-F265 HydrophobicContact CB-CZ 4.14Å; H220-F265 AromaticContact CD2-CD1 3.78Å; H220-F265 AromaticContact CD2-CE1 3.43Å; H220-F265 VanDerWaalsContact CD2-CE1 3.43Å; H220-F265 WeakPolarHBondContact CD2-CE1 3.27Å; H220-F265 AromaticContact CD2-CZ 3.83Å; H220-E270 PolarHBondContact NE2-O 3.48Å
221	L	96.9	Very high	96.3	Very high	68 Å²	68	34.3 Å²	34.3	36%	0.356	17%	0.166	S	C	.	.	S	Bend	trans	-75.1	-25.3	-171.9	-60.5	178.6	0	0	0	114	P171 N172 F265 P267	P171-L221 HydrophobicContact CG-CD2 4.17Å; N172-L221 VanDerWaalsContact ND2-C 3.26Å; N172-L221 PolarHBondContact ND2-O 2.82Å; N172-L221 PolarHBondContact OD1-O 3.36Å; L221-F265 HydrophobicContact CD1-CB 4.01Å; L221-F265 HydrophobicContact CG-CB 3.89Å; L221-P267 HydrophobicContact CD1-CB 3.99Å
222	I	96.2	Very high	96.3	Very high	98 Å²	98	27.6 Å²	27.6	50%	0.503	14%	0.139	S	C	.	.	S	Bend	trans	-109.1	-51.1	177.7	-61.2	160.5	0	0	0	113.2	N172 H220 E224 E270	N172-I222 PolarHBondContact ND2-O 2.69Å; H220-I222 PolarHBondContact ND1-N 3.04Å; H220-I222 PolarHBondContact O-N 3.48Å; I222-E224 PolarHBondContact O-N 2.69Å; I222-E270 HydrophobicContact CD1-CB 3.73Å
223	H	96.6	Very high	96.5	Very high	69 Å²	69	28.8 Å²	28.8	32%	0.319	14%	0.143	S	C	.	.			trans	-80.9	105.5	-178.8	-61.2	-60	0	0	0	112.3	H220 T225 L226 E270	H220-H223 HydrophobicContact CB-CB 4.41Å; H220-H223 AromaticContact CE1-CD2 3.39Å; H220-H223 PolarHBondContact CE1-CD2 2.91Å; H220-H223 AromaticContact ND1-CD2 3.73Å; H220-H223 PolarHBondContact ND1-N 2.85Å; H220-H223 AromaticContact NE2-CD2 3.71Å; H223-T225 PolarHBondContact O-N 2.96Å; H223-L226 HydrophobicContact CB-CB 4.21Å; H223-L226 HydrophobicContact CB-CD1 3.85Å; H223-L226 HydrophobicContact CB-CG 4.03Å; H223-L226 PolarHBondContact O-N 2.81Å; H223-E270 IonicContact CE1-OE2 2.97Å; H223-E270 IonicContact NE2-OE2 2.7Å; H223-E270 PolarHBondContact NE2-OE2 2.77Å
224	E	96.2	Very high	96.7	Very high	102 Å²	102	30.5 Å²	30.5	48%	0.477	15%	0.148	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.6	-23.7	-175.5	74.6	-176.8	173.3	0	0	115.4	N170 N172 W219 I222	N170-E224 PolarHBondContact ND2-O 2.88Å; N172-E224 HydrophobicContact CB-CB 3.59Å; W219-E224 WeakPolarHBondContact CZ3-O 3.12Å; I222-E224 PolarHBondContact O-N 2.69Å
225	T	96.1	Very high	96.9	Very high	19 Å²	19	33.8 Å²	33.8	12%	0.117	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.3	-6.2	-172.9	67.3	0	0	0	0	114	H223 D240 V241 R242	H223-T225 PolarHBondContact O-N 2.96Å; T225-D240 WeakPolarHBondContact O-CA 3.38Å; T225-D240 PolarHBondContact OG1-OD1 3.02Å; T225-V241 HydrophobicContact CG2-CG2 3.99Å; T225-V241 PolarHBondContact O-N 3.25Å; T225-R242 HydrophobicContact CG2-CG 3.85Å; T225-R242 PolarHBondContact OG1-NE 3.07Å
226	L	97.2	Very high	97.1	Very high	36 Å²	36	29.6 Å²	29.6	19%	0.188	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	138.1	-173.6	-64.6	-178.1	0	0	0	111.2	H220 H223 W239 D240	H220-L226 HydrophobicContact CB-CB 3.81Å; H220-L226 WeakPolarHBondContact CB-O 3.08Å; H220-L226 PolarHBondContact N-O 2.84Å; H223-L226 HydrophobicContact CB-CB 4.21Å; H223-L226 HydrophobicContact CB-CD1 3.85Å; H223-L226 HydrophobicContact CB-CG 4.03Å; H223-L226 PolarHBondContact O-N 2.81Å; L226-W239 WeakPolarHBondContact CA-O 3.41Å; L226-W239 WeakPolarHBondContact CD2-O 3.28Å; L226-D240 HydrophobicContact CD2-CB 3.75Å
227	F	98.1	Very high	97.2	Very high	1 Å²	1	29.4 Å²	29.4	0%	0.004	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	160.7	170.7	67	-87.7	0	0	0	111	L178 V186 I188 F207 A218 W219 T229 W239 V241	L178-F227 HydrophobicContact CD1-CD2 4.1Å; L178-F227 HydrophobicContact CD1-CE2 4Å; L178-F227 HydrophobicContact CD1-CG 4.47Å; L178-F227 HydrophobicContact CD1-CZ 4.31Å; L178-F227 HydrophobicContact CD2-CB 3.87Å; L178-F227 HydrophobicContact CD2-CD2 3.56Å; L178-F227 HydrophobicContact CD2-CE2 4.26Å; L178-F227 HydrophobicContact CD2-CG 3.84Å; L178-F227 HydrophobicContact CG-CD2 4.49Å; V186-F227 HydrophobicContact CG1-CE2 4.25Å; I188-F227 HydrophobicContact CD1-CE1 4.11Å; F207-F227 HydrophobicContact CD1-CZ 4.27Å; F207-F227 AromaticContact CD2-CZ 3.82Å; F207-F227 HydrophobicContact CD2-CZ 3.82Å; F207-F227 HydrophobicContact CE1-CE1 4.44Å; F207-F227 HydrophobicContact CE1-CZ 4.16Å; F207-F227 HydrophobicContact CE2-CE1 4.16Å; F207-F227 AromaticContact CE2-CZ 3.75Å; F207-F227 HydrophobicContact CE2-CZ 3.75Å; F207-F227 HydrophobicContact CG-CZ 4.1Å; F207-F227 HydrophobicContact CZ-CE1 4.03Å; F207-F227 AromaticContact CZ-CZ 3.91Å; F207-F227 HydrophobicContact CZ-CZ 3.91Å; A218-F227 CarbonylContact O-C 3.1Å; A218-F227 VanDerWaalsContact O-CA 3.23Å; A218-F227 WeakPolarHBondContact O-CA 3.35Å; A218-F227 VanDerWaalsContact O-CB 3.28Å; A218-F227 WeakPolarHBondContact O-CB 3.48Å; W219-F227 HydrophobicContact CD2-CB 4.11Å; W219-F227 HydrophobicContact CE3-CB 3.77Å; W219-F227 HydrophobicContact CE3-CD1 4.23Å; W219-F227 HydrophobicContact CE3-CG 4.42Å; W219-F227 AromaticContact CH2-CD1 3.97Å; W219-F227 HydrophobicContact CH2-CD1 3.97Å; W219-F227 HydrophobicContact CZ3-CB 4.17Å; W219-F227 AromaticContact CZ3-CD1 3.74Å; W219-F227 HydrophobicContact CZ3-CD1 3.74Å; W219-F227 HydrophobicContact CZ3-CG 4.36Å; F227-T229 HydrophobicContact CD2-CG2 3.65Å; F227-T229 HydrophobicContact CE2-CG2 3.57Å; F227-W239 HydrophobicContact CD1-CB 3.75Å; F227-W239 HydrophobicContact CD2-CB 3.92Å; F227-W239 AromaticContact CD2-CD1 3.66Å; F227-W239 HydrophobicContact CD2-CG 4.02Å; F227-W239 HydrophobicContact CE1-CB 3.34Å; F227-W239 HydrophobicContact CE1-CG 4.06Å; F227-W239 HydrophobicContact CE2-CB 3.54Å; F227-W239 AromaticContact CE2-CD1 3.21Å; F227-W239 HydrophobicContact CE2-CD2 4.22Å; F227-W239 AromaticContact CE2-CG 3.38Å; F227-W239 HydrophobicContact CE2-CG 3.38Å; F227-W239 AromaticContact CE2-NE1 3.89Å; F227-W239 HydrophobicContact CG-CB 4.03Å; F227-W239 HydrophobicContact CZ-CB 3.23Å; F227-W239 AromaticContact CZ-CD1 3.76Å; F227-W239 HydrophobicContact CZ-CD2 4.08Å; F227-W239 AromaticContact CZ-CG 3.4Å; F227-W239 HydrophobicContact CZ-CG 3.4Å; F227-W239 VanDerWaalsContact CZ-CG 3.4Å; F227-W239 PolarHBondContact N-O 3.24Å; F227-W239 PolarHBondContact O-N 3.48Å; F227-V241 HydrophobicContact CD1-CG1 4.08Å; F227-V241 HydrophobicContact CE1-CG1 3.67Å
228	V	98.2	Very high	97.3	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	143.5	178	173.4	0	0	0	0	109.9	V217 A218 V230 L236 H237 V238 V263 F265	V217-V228 WeakPolarHBondContact CA-O 3.39Å; A218-V228 PolarHBondContact N-O 3.29Å; A218-V228 PolarHBondContact O-N 2.93Å; V228-V230 HydrophobicContact CG1-CG1 4.37Å; V228-L236 HydrophobicContact CG1-CD1 4.14Å; V228-L236 HydrophobicContact CG1-CD2 3.92Å; V228-L236 HydrophobicContact CG1-CG 3.8Å; V228-H237 VanDerWaalsContact CA-O 3.29Å; V228-H237 WeakPolarHBondContact CA-O 3.42Å; V228-V238 HydrophobicContact CG2-CB 4.49Å; V228-V238 HydrophobicContact CG2-CG1 4.41Å; V228-V238 HydrophobicContact CG2-CG2 4.07Å; V228-V263 HydrophobicContact CB-CG2 4.36Å; V228-V263 HydrophobicContact CG1-CG2 3.84Å; V228-F265 HydrophobicContact CB-CE2 4.19Å; V228-F265 HydrophobicContact CB-CZ 4.17Å; V228-F265 HydrophobicContact CG2-CE1 4.47Å; V228-F265 HydrophobicContact CG2-CE2 4.04Å; V228-F265 HydrophobicContact CG2-CZ 3.52Å
229	T	97.3	Very high	97.3	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	143.3	176.5	65.1	0	0	0	0	109.4	V186 H210 V217 F227 H237 W239	V186-T229 HydrophobicContact CB-CG2 4.47Å; V186-T229 HydrophobicContact CG1-CG2 4.16Å; V186-T229 HydrophobicContact CG2-CG2 3.92Å; H210-T229 PolarHBondContact CD2-OG1 3.23Å; H210-T229 PolarHBondContact NE2-OG1 3.39Å; V217-T229 HydrophobicContact CB-CG2 4.39Å; V217-T229 HydrophobicContact CG1-CG2 3.82Å; F227-T229 HydrophobicContact CD2-CG2 3.65Å; F227-T229 HydrophobicContact CE2-CG2 3.57Å; T229-H237 PolarHBondContact N-O 2.86Å; T229-H237 PolarHBondContact O-N 3.05Å; T229-H237 WeakPolarHBondContact OG1-CB 3.38Å; T229-W239 PolarHBondContact OG1-NE1 3.09Å
230	V	97.1	Very high	97.1	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	144.5	-179.5	-64.9	0	0	0	0	110.4	V214 R215 D216 V228 L236 I260 V263 T275	V214-V230 CarbonylContact C-O 3.59Å; V214-V230 WeakPolarHBondContact CG1-O 3.27Å; R215-V230 PolarHBondContact N-O 2.83Å; D216-V230 HydrophobicContact CB-CG2 3.8Å; D216-V230 PolarHBondContact N-O 3.49Å; D216-V230 PolarHBondContact O-N 3.37Å; V228-V230 HydrophobicContact CG1-CG1 4.37Å; V230-L236 HydrophobicContact CG1-CB 4.42Å; V230-L236 HydrophobicContact CG1-CD1 4.37Å; V230-L236 HydrophobicContact CG1-CG 4.2Å; V230-I260 HydrophobicContact CB-CB 3.85Å; V230-I260 HydrophobicContact CB-CD1 4.4Å; V230-I260 HydrophobicContact CB-CG2 3.55Å; V230-I260 HydrophobicContact CG1-CB 4.46Å; V230-I260 HydrophobicContact CG1-CD1 4.4Å; V230-I260 HydrophobicContact CG1-CG2 3.81Å; V230-I260 HydrophobicContact CG2-CB 4.39Å; V230-I260 HydrophobicContact CG2-CG2 3.86Å; V230-V263 HydrophobicContact CG1-CB 3.96Å; V230-V263 HydrophobicContact CG1-CG1 4.25Å; V230-V263 HydrophobicContact CG1-CG2 4.47Å; V230-V263 HydrophobicContact CG2-CB 4.07Å; V230-V263 HydrophobicContact CG2-CG1 3.92Å; V230-T275 HydrophobicContact CG1-CG2 4.16Å
231	A	96.4	Very high	96.9	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	173.8	-168.8	0	0	0	0	0	114.3	H210 T213 V214 D233 K234 R235 I260	H210-A231 HydrophobicContact CB-CB 4.23Å; H210-A231 WeakPolarHBondContact ND1-CB 3.49Å; T213-A231 CarbonylContact O-C 3.6Å; T213-A231 VanDerWaalsContact O-CA 3.29Å; T213-A231 WeakPolarHBondContact O-CA 3.44Å; T213-A231 WeakPolarHBondContact O-CB 3.42Å; V214-A231 HydrophobicContact CB-CB 4.43Å; V214-A231 HydrophobicContact CG2-CB 4.28Å; A231-D233 WeakPolarHBondContact CB-OD1 3.18Å; A231-D233 PolarHBondContact O-N 2.76Å; A231-K234 PolarHBondContact O-N 3.06Å; A231-R235 PolarHBondContact N-O 2.75Å; A231-I260 PolarHBondContact O-N 3.22Å
232	D	95.7	Very high	96.7	Very high	40 Å²	40	36.2 Å²	36.2	21%	0.214	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-18.9	175.1	-77	-11.8	0	0	0	114.2	T213 R215 K234 P259	T213-D232 PolarHBondContact O-N 3.36Å; R215-D232 WeakPolarHBondContact CG-OD1 3.25Å; R215-D232 IonicContact CZ-OD1 3.8Å; R215-D232 IonicContact CZ-OD2 2.89Å; R215-D232 VanDerWaalsContact NE-CG 3.32Å; R215-D232 IonicContact NE-OD1 2.94Å; R215-D232 PolarHBondContact NE-OD1 2.82Å; R215-D232 IonicContact NE-OD2 3.26Å; R215-D232 PolarHBondContact NE-OD2 3.08Å; R215-D232 IonicContact NH2-OD1 3.24Å; R215-D232 PolarHBondContact NH2-OD1 3.48Å; R215-D232 IonicContact NH2-OD2 3.4Å; R215-D232 PolarHBondContact NH2-OD2 2.84Å; D232-K234 PolarHBondContact O-N 3.26Å; D232-K234 VanDerWaalsContact O-N 3.15Å; D232-P259 HydrophobicContact CB-CB 4.43Å; D232-P259 HydrophobicContact CB-CG 4.5Å; D232-P259 WeakPolarHBondContact OD1-CB 3.39Å
233	D	96.7	Very high	96.3	Very high	34 Å²	34	34.2 Å²	34.2	18%	0.182	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.9	6.1	173.7	65.6	8.6	0	0	0	113.4	H210 K211 A231 R235	H210-D233 VanDerWaalsContact CA-OD2 3.31Å; H210-D233 WeakPolarHBondContact CA-OD2 3.32Å; H210-D233 WeakPolarHBondContact CB-OD2 3.16Å; H210-D233 IonicContact CE1-OD1 3.29Å; H210-D233 IonicContact CG-OD2 3.61Å; H210-D233 IonicContact ND1-OD1 3.3Å; H210-D233 PolarHBondContact ND1-OD1 2.82Å; H210-D233 IonicContact ND1-OD2 2.96Å; H210-D233 PolarHBondContact ND1-OD2 3.41Å; K211-D233 HydrophobicContact CB-CB 4.23Å; K211-D233 PolarHBondContact N-OD2 3.24Å; A231-D233 WeakPolarHBondContact CB-OD1 3.18Å; A231-D233 PolarHBondContact O-N 2.76Å; D233-R235 PolarHBondContact O-N 3.23Å; D233-R235 VanDerWaalsContact OD1-CB 3.24Å; D233-R235 WeakPolarHBondContact OD1-CB 3.4Å; D233-R235 PolarHBondContact OD1-N 3.33Å
234	K	98.1	Very high	95.3	Very high	61 Å²	61	41.9 Å²	41.9	27%	0.265	18%	0.184	S	C	.	.	S	Bend	trans	68	10.7	178	-42.6	175.4	177	-161.1	0	112.6	A231 D232 A255 H256 I257 E258	A231-K234 PolarHBondContact O-N 3.06Å; D232-K234 PolarHBondContact O-N 3.26Å; D232-K234 VanDerWaalsContact O-N 3.15Å; K234-A255 PolarHBondContact O-N 3.38Å; K234-H256 WeakPolarHBondContact CB-O 3.47Å; K234-I257 VanDerWaalsContact CD-O 3.32Å; K234-I257 WeakPolarHBondContact CD-O 3.2Å; K234-I257 VanDerWaalsContact CE-O 3.31Å; K234-I257 WeakPolarHBondContact CE-O 3.36Å; K234-I257 PolarHBondContact NZ-O 3.4Å; K234-E258 IonicContact NZ-OE1 2.83Å; K234-E258 PolarHBondContact NZ-OE1 3.28Å
235	R	98.1	Very high	94.3	Very high	70 Å²	70	40.9 Å²	40.9	26%	0.264	19%	0.185	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	142.8	-179	-59.4	-55.9	-175.4	119.8	-20.4	112	H210 A231 D233 D252 I253 E254	H210-R235 PolarHBondContact CE1-O 3.32Å; A231-R235 PolarHBondContact N-O 2.75Å; D233-R235 PolarHBondContact O-N 3.23Å; D233-R235 VanDerWaalsContact OD1-CB 3.24Å; D233-R235 WeakPolarHBondContact OD1-CB 3.4Å; D233-R235 PolarHBondContact OD1-N 3.33Å; R235-D252 WeakPolarHBondContact CD-OD1 3.48Å; R235-D252 IonicContact CZ-OD1 3.14Å; R235-D252 IonicContact NE-OD1 3.56Å; R235-D252 VanDerWaalsContact NH1-CG 3.3Å; R235-D252 IonicContact NH1-OD1 3.49Å; R235-D252 PolarHBondContact NH1-OD1 2.73Å; R235-D252 IonicContact NH1-OD2 3.99Å; R235-D252 PolarHBondContact NH1-OD2 2.85Å; R235-I253 CarbonylContact C-O 3.59Å; R235-I253 VanDerWaalsContact CA-O 3.28Å; R235-I253 WeakPolarHBondContact CA-O 3.45Å; R235-I253 WeakPolarHBondContact CD-O 3.36Å; R235-E254 IonicContact CZ-OE2 3.07Å; R235-E254 IonicContact NE-OE2 2.76Å; R235-E254 IonicContact NH2-OE2 2.95Å; R235-E254 PolarHBondContact NH2-OE2 2.77Å
236	L	98.2	Very high	93.4	Very high	0 Å²	0	44 Å²	44	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	129.8	163.9	-175.9	155.1	0	0	0	107.9	V228 V230 V238 I253 A255 F273 T275	V228-L236 HydrophobicContact CG1-CD1 4.14Å; V228-L236 HydrophobicContact CG1-CD2 3.92Å; V228-L236 HydrophobicContact CG1-CG 3.8Å; V230-L236 HydrophobicContact CG1-CB 4.42Å; V230-L236 HydrophobicContact CG1-CD1 4.37Å; V230-L236 HydrophobicContact CG1-CG 4.2Å; L236-V238 HydrophobicContact CD2-CG2 3.7Å; L236-I253 HydrophobicContact CB-CB 4.48Å; L236-I253 HydrophobicContact CD2-CD1 3.92Å; L236-I253 PolarHBondContact N-O 3.42Å; L236-I253 PolarHBondContact O-N 3.03Å; L236-A255 HydrophobicContact CB-CB 3.73Å; L236-A255 HydrophobicContact CD1-CB 4.42Å; L236-F273 HydrophobicContact CD1-CE2 3.39Å; L236-F273 HydrophobicContact CD1-CZ 3.84Å; L236-F273 HydrophobicContact CD2-CZ 4.38Å; L236-T275 HydrophobicContact CD1-CG2 3.63Å
237	H	97.9	Very high	92.6	Very high	3 Å²	3	51.1 Å²	51.1	1%	0.014	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	131.7	172.9	-71.4	-1.6	0	0	0	110.7	S209 H210 V228 T229 W239 P249 H251 D252	S209-H237 PolarHBondContact OG-CD2 3.03Å; S209-H237 PolarHBondContact OG-NE2 2.97Å; H210-H237 AromaticContact CD2-CD2 3.82Å; H210-H237 AromaticContact CE1-CD2 3.6Å; H210-H237 AromaticContact CE1-CG 3.69Å; H210-H237 AromaticContact CE1-NE2 3.94Å; H210-H237 AromaticContact ND1-CD2 3.9Å; H210-H237 AromaticContact ND1-NE2 3.87Å; H210-H237 AromaticContact NE2-CD2 3.55Å; H210-H237 AromaticContact NE2-CG 3.73Å; V228-H237 VanDerWaalsContact CA-O 3.29Å; V228-H237 WeakPolarHBondContact CA-O 3.42Å; T229-H237 PolarHBondContact N-O 2.86Å; T229-H237 PolarHBondContact O-N 3.05Å; T229-H237 WeakPolarHBondContact OG1-CB 3.38Å; H237-W239 HydrophobicContact CB-CZ2 4.17Å; H237-W239 VanDerWaalsContact CB-NE1 3.33Å; H237-W239 AromaticContact CD2-CZ2 3.71Å; H237-P249 HydrophobicContact CB-CB 3.77Å; H237-P249 HydrophobicContact CB-CG 4.2Å; H237-H251 VanDerWaalsContact CA-O 3.29Å; H237-H251 WeakPolarHBondContact CA-O 3.39Å; H237-D252 VanDerWaalsContact CE1-CG 3.41Å; H237-D252 IonicContact CE1-OD1 2.81Å; H237-D252 PolarHBondContact CE1-OD1 3.34Å; H237-D252 IonicContact ND1-OD1 3.66Å; H237-D252 PolarHBondContact ND1-OD1 2.93Å
238	V	97.9	Very high	92.2	Very high	7 Å²	7	58.6 Å²	58.6	4%	0.042	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	127.2	169.5	-174.1	0	0	0	0	108.4	V228 L236 P249 S250 H251 L287 L290	V228-V238 HydrophobicContact CG2-CB 4.49Å; V228-V238 HydrophobicContact CG2-CG1 4.41Å; V228-V238 HydrophobicContact CG2-CG2 4.07Å; L236-V238 HydrophobicContact CD2-CG2 3.7Å; V238-P249 CarbonylContact O-C 3.56Å; V238-S250 WeakPolarHBondContact O-CA 3.27Å; V238-S250 WeakPolarHBondContact O-CB 3.48Å; V238-S250 PolarHBondContact O-N 3.15Å; V238-H251 HydrophobicContact CB-CB 4.03Å; V238-H251 HydrophobicContact CG2-CB 4.04Å; V238-H251 PolarHBondContact N-O 3.33Å; V238-H251 PolarHBondContact O-N 2.86Å; V238-L287 HydrophobicContact CG1-CD2 4.18Å; V238-L287 HydrophobicContact CG2-CD2 4.2Å; V238-L290 HydrophobicContact CG2-CD1 3.63Å
239	W	97.5	Very high	92.1	Very high	4 Å²	4	59.5 Å²	59.5	2%	0.015	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	146.4	-175.5	-60.8	93.4	0	0	0	111.6	F207 S209 L226 F227 T229 H237 P249	F207-W239 HydrophobicContact CB-CE3 4.37Å; F207-W239 HydrophobicContact CB-CH2 3.82Å; F207-W239 HydrophobicContact CB-CZ2 4.02Å; F207-W239 HydrophobicContact CB-CZ3 4.02Å; F207-W239 HydrophobicContact CD1-CD2 4.14Å; F207-W239 AromaticContact CD1-CE3 3.5Å; F207-W239 HydrophobicContact CD1-CE3 3.5Å; F207-W239 HydrophobicContact CD1-CH2 4.3Å; F207-W239 AromaticContact CD1-CZ3 3.61Å; F207-W239 HydrophobicContact CD1-CZ3 3.61Å; F207-W239 HydrophobicContact CE1-CE3 4.17Å; F207-W239 HydrophobicContact CG-CE3 4.22Å; F207-W239 HydrophobicContact CG-CZ3 4.24Å; S209-W239 VanDerWaalsContact CB-CH2 3.47Å; L226-W239 WeakPolarHBondContact CA-O 3.41Å; L226-W239 WeakPolarHBondContact CD2-O 3.28Å; F227-W239 HydrophobicContact CD1-CB 3.75Å; F227-W239 HydrophobicContact CD2-CB 3.92Å; F227-W239 AromaticContact CD2-CD1 3.66Å; F227-W239 HydrophobicContact CD2-CG 4.02Å; F227-W239 HydrophobicContact CE1-CB 3.34Å; F227-W239 HydrophobicContact CE1-CG 4.06Å; F227-W239 HydrophobicContact CE2-CB 3.54Å; F227-W239 AromaticContact CE2-CD1 3.21Å; F227-W239 HydrophobicContact CE2-CD2 4.22Å; F227-W239 AromaticContact CE2-CG 3.38Å; F227-W239 HydrophobicContact CE2-CG 3.38Å; F227-W239 AromaticContact CE2-NE1 3.89Å; F227-W239 HydrophobicContact CG-CB 4.03Å; F227-W239 HydrophobicContact CZ-CB 3.23Å; F227-W239 AromaticContact CZ-CD1 3.76Å; F227-W239 HydrophobicContact CZ-CD2 4.08Å; F227-W239 AromaticContact CZ-CG 3.4Å; F227-W239 HydrophobicContact CZ-CG 3.4Å; F227-W239 VanDerWaalsContact CZ-CG 3.4Å; F227-W239 PolarHBondContact N-O 3.24Å; F227-W239 PolarHBondContact O-N 3.48Å; T229-W239 PolarHBondContact OG1-NE1 3.09Å; H237-W239 HydrophobicContact CB-CZ2 4.17Å; H237-W239 VanDerWaalsContact CB-NE1 3.33Å; H237-W239 AromaticContact CD2-CZ2 3.71Å; W239-P249 HydrophobicContact CD2-CB 3.94Å; W239-P249 HydrophobicContact CE3-CB 3.98Å; W239-P249 HydrophobicContact CH2-CB 4.09Å; W239-P249 HydrophobicContact CZ2-CB 4.05Å; W239-P249 HydrophobicContact CZ3-CB 4.04Å
240	D	95.4	Very high	92	Very high	27 Å²	27	62.1 Å²	62.1	14%	0.144	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	114.1	168.4	-173.9	-21.1	0	0	0	108.5	T225 L226 R242 N243	T225-D240 WeakPolarHBondContact O-CA 3.38Å; T225-D240 PolarHBondContact OG1-OD1 3.02Å; L226-D240 HydrophobicContact CD2-CB 3.75Å; D240-R242 PolarHBondContact O-N 2.85Å; D240-R242 VanDerWaalsContact O-N 3.07Å; D240-R242 VanDerWaalsContact OD1-CB 3.23Å; D240-R242 WeakPolarHBondContact OD1-CB 3.24Å; D240-R242 VanDerWaalsContact OD1-CG 3.28Å; D240-R242 WeakPolarHBondContact OD1-CG 3.26Å; D240-R242 IonicContact OD1-CZ 3.36Å; D240-R242 PolarHBondContact OD1-N 2.68Å; D240-R242 IonicContact OD1-NE 2.7Å; D240-R242 PolarHBondContact OD1-NE 2.95Å; D240-R242 IonicContact OD1-NH2 3.53Å; D240-R242 IonicContact OD2-CZ 3.89Å; D240-R242 VanDerWaalsContact OD2-CZ 3.29Å; D240-R242 IonicContact OD2-NE 3.89Å; D240-R242 PolarHBondContact OD2-NE 3.42Å; D240-R242 VanDerWaalsContact OD2-NE 3.07Å; D240-R242 IonicContact OD2-NH2 2.95Å; D240-R242 PolarHBondContact OD2-NH2 3.16Å; D240-N243 WeakPolarHBondContact O-CB 3.43Å; D240-N243 PolarHBondContact O-N 3.22Å
241	V	94.1	Very high	91.9	Very high	22 Å²	22	66.4 Å²	66.4	13%	0.133	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-17.6	-176.5	-61.6	0	0	0	0	113.4	I188 F207 W219 T225 F227 N243 R246	I188-V241 HydrophobicContact CD1-CG1 3.43Å; I188-V241 VanDerWaalsContact CD1-CG1 3.43Å; F207-V241 HydrophobicContact CZ-CG1 4.22Å; W219-V241 HydrophobicContact CH2-CG1 3.89Å; W219-V241 HydrophobicContact CZ3-CG1 4.22Å; T225-V241 HydrophobicContact CG2-CG2 3.99Å; T225-V241 PolarHBondContact O-N 3.25Å; F227-V241 HydrophobicContact CD1-CG1 4.08Å; F227-V241 HydrophobicContact CE1-CG1 3.67Å; V241-N243 VanDerWaalsContact C-N 3.26Å; V241-N243 PolarHBondContact O-N 3.17Å; V241-R246 PolarHBondContact O-NE 3.01Å; V241-R246 PolarHBondContact O-NH2 3.1Å
242	R	92	Very high	91.9	Very high	167 Å²	167	70.4 Å²	70.4	63%	0.63	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.8	-21.3	175.5	-57.4	175.4	-65.7	-171.8	2	112.2	T225 D240 R244	T225-R242 HydrophobicContact CG2-CG 3.85Å; T225-R242 PolarHBondContact OG1-NE 3.07Å; D240-R242 PolarHBondContact O-N 2.85Å; D240-R242 VanDerWaalsContact O-N 3.07Å; D240-R242 VanDerWaalsContact OD1-CB 3.23Å; D240-R242 WeakPolarHBondContact OD1-CB 3.24Å; D240-R242 VanDerWaalsContact OD1-CG 3.28Å; D240-R242 WeakPolarHBondContact OD1-CG 3.26Å; D240-R242 IonicContact OD1-CZ 3.36Å; D240-R242 PolarHBondContact OD1-N 2.68Å; D240-R242 IonicContact OD1-NE 2.7Å; D240-R242 PolarHBondContact OD1-NE 2.95Å; D240-R242 IonicContact OD1-NH2 3.53Å; D240-R242 IonicContact OD2-CZ 3.89Å; D240-R242 VanDerWaalsContact OD2-CZ 3.29Å; D240-R242 IonicContact OD2-NE 3.89Å; D240-R242 PolarHBondContact OD2-NE 3.42Å; D240-R242 VanDerWaalsContact OD2-NE 3.07Å; D240-R242 IonicContact OD2-NH2 2.95Å; D240-R242 PolarHBondContact OD2-NH2 3.16Å; R242-R244 PolarHBondContact O-N 3.47Å
243	N	87.2	Confident	92.1	Very high	57 Å²	57	69.8 Å²	69.8	31%	0.305	31%	0.31	S	S	.	.			trans	-68.5	99	177.5	-177.7	-6.3	0	0	0	109.9	D240 V241 T245 R246	D240-N243 WeakPolarHBondContact O-CB 3.43Å; D240-N243 PolarHBondContact O-N 3.22Å; V241-N243 VanDerWaalsContact C-N 3.26Å; V241-N243 PolarHBondContact O-N 3.17Å; N243-T245 PolarHBondContact O-N 2.93Å; N243-T245 PolarHBondContact OD1-N 3Å; N243-T245 PolarHBondContact OD1-OG1 2.89Å; N243-R246 WeakPolarHBondContact O-CG 3.46Å; N243-R246 PolarHBondContact O-N 3.21Å
244	R	75.7	Confident	92.1	Very high	230 Å²	230	74 Å²	74	87%	0.868	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.1	-27.3	-176.7	-66.1	-173.2	174.9	-166.5	-2.4	115	R242 R246	R242-R244 PolarHBondContact O-N 3.47Å; R244-R246 VanDerWaalsContact C-N 3.33Å
245	T	76.4	Confident	92.1	Very high	80 Å²	80	71.2 Å²	71.2	49%	0.491	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.2	-32.6	-179.7	62.9	0	0	0	0	111.5	N243 R247	N243-T245 PolarHBondContact O-N 2.93Å; N243-T245 PolarHBondContact OD1-N 3Å; N243-T245 PolarHBondContact OD1-OG1 2.89Å; T245-R247 VanDerWaalsContact O-CG 3.3Å; T245-R247 WeakPolarHBondContact O-CG 3.44Å; T245-R247 PolarHBondContact O-N 3.45Å
246	R	76.3	Confident	92.1	Very high	84 Å²	84	68.1 Å²	68.1	32%	0.317	31%	0.305	S	S	.	.			trans	45.6	3.7	-177.6	-58.4	-170.3	178.9	109.9	-8.2	116.8	D205 F207 V241 N243 R244	D205-R246 WeakPolarHBondContact OD1-CD 3.23Å; D205-R246 IonicContact OD1-CZ 2.69Å; D205-R246 IonicContact OD1-NE 2.68Å; D205-R246 PolarHBondContact OD1-NE 3.31Å; D205-R246 VanDerWaalsContact OD1-NE 3.16Å; D205-R246 IonicContact OD1-NH1 3.83Å; D205-R246 PolarHBondContact OD1-NH1 2.8Å; D205-R246 IonicContact OD1-NH2 2.84Å; D205-R246 IonicContact OD2-CZ 2.85Å; D205-R246 IonicContact OD2-NE 3.89Å; D205-R246 PolarHBondContact OD2-NE 3.37Å; D205-R246 IonicContact OD2-NH1 2.69Å; D205-R246 IonicContact OD2-NH2 3.48Å; D205-R246 PolarHBondContact OD2-NH2 2.95Å; F207-R246 HydrophobicContact CD1-CB 4.1Å; F207-R246 HydrophobicContact CE1-CB 3.86Å; F207-R246 HydrophobicContact CE1-CG 3.9Å; V241-R246 PolarHBondContact O-NE 3.01Å; V241-R246 PolarHBondContact O-NH2 3.1Å; N243-R246 WeakPolarHBondContact O-CG 3.46Å; N243-R246 PolarHBondContact O-N 3.21Å; R244-R246 VanDerWaalsContact C-N 3.33Å
247	R	80.9	Confident	92	Very high	187 Å²	187	74.1 Å²	74.1	71%	0.706	34%	0.336	S	S	*	.	S	Bend	trans	-84.2	-27.1	-176.5	-80	174.6	-175.2	-161.5	0.5	112.5	T245	T245-R247 VanDerWaalsContact O-CG 3.3Å; T245-R247 WeakPolarHBondContact O-CG 3.44Å; T245-R247 PolarHBondContact O-N 3.45Å
248	Y	90.2	Very high	92	Very high	158 Å²	158	78 Å²	78	62%	0.62	35%	0.354	S	S	*	.	S	Bend	trans	-127.3	135.6	-177.6	-54.4	-69.5	0	0	0	108.9
249	P	94.9	Very high	92	Very high	19 Å²	19	78.6 Å²	78.6	12%	0.123	36%	0.358	C	S	.	.			trans	-64.4	155.1	171.2	32.2	-37.7	0	0	0	109.6	S209 H237 V238 W239 H251 D252	S209-P249 WeakPolarHBondContact OG-CD 3.39Å; H237-P249 HydrophobicContact CB-CB 3.77Å; H237-P249 HydrophobicContact CB-CG 4.2Å; V238-P249 CarbonylContact O-C 3.56Å; W239-P249 HydrophobicContact CD2-CB 3.94Å; W239-P249 HydrophobicContact CE3-CB 3.98Å; W239-P249 HydrophobicContact CH2-CB 4.09Å; W239-P249 HydrophobicContact CZ2-CB 4.05Å; W239-P249 HydrophobicContact CZ3-CB 4.04Å; P249-H251 WeakPolarHBondContact CB-O 3.29Å; P249-H251 PolarHBondContact O-N 2.99Å; P249-D252 HydrophobicContact CG-CB 3.96Å
250	S	94.9	Very high	92	Very high	55 Å²	55	78.4 Å²	78.4	39%	0.385	36%	0.358	S	S	.	.	S	Bend	trans	-63.2	-33.1	172.6	-59.6	0	0	0	0	110.9	V238	V238-S250 WeakPolarHBondContact O-CA 3.27Å; V238-S250 WeakPolarHBondContact O-CB 3.48Å; V238-S250 PolarHBondContact O-N 3.15Å
251	H	96.2	Very high	92	Very high	89 Å²	89	78.9 Å²	78.9	41%	0.412	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	135.8	172.1	-58.6	79.1	0	0	0	110.4	H237 V238 P249 I253 L290	H237-H251 VanDerWaalsContact CA-O 3.29Å; H237-H251 WeakPolarHBondContact CA-O 3.39Å; V238-H251 HydrophobicContact CB-CB 4.03Å; V238-H251 HydrophobicContact CG2-CB 4.04Å; V238-H251 PolarHBondContact N-O 3.33Å; V238-H251 PolarHBondContact O-N 2.86Å; P249-H251 WeakPolarHBondContact CB-O 3.29Å; P249-H251 PolarHBondContact O-N 2.99Å; H251-I253 HydrophobicContact CB-CD1 3.75Å; H251-I253 HydrophobicContact CB-CG1 4.49Å; H251-L290 HydrophobicContact CB-CD1 3.94Å
252	D	96.6	Very high	92.1	Very high	85 Å²	85	77.9 Å²	77.9	46%	0.455	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	111.7	171.3	167.8	17	0	0	0	108.2	R235 H237 P249	R235-D252 WeakPolarHBondContact CD-OD1 3.48Å; R235-D252 IonicContact CZ-OD1 3.14Å; R235-D252 IonicContact NE-OD1 3.56Å; R235-D252 VanDerWaalsContact NH1-CG 3.3Å; R235-D252 IonicContact NH1-OD1 3.49Å; R235-D252 PolarHBondContact NH1-OD1 2.73Å; R235-D252 IonicContact NH1-OD2 3.99Å; R235-D252 PolarHBondContact NH1-OD2 2.85Å; H237-D252 VanDerWaalsContact CE1-CG 3.41Å; H237-D252 IonicContact CE1-OD1 2.81Å; H237-D252 PolarHBondContact CE1-OD1 3.34Å; H237-D252 IonicContact ND1-OD1 3.66Å; H237-D252 PolarHBondContact ND1-OD1 2.93Å; P249-D252 HydrophobicContact CG-CB 3.96Å
253	I	97.9	Very high	92.4	Very high	26 Å²	26	70.2 Å²	70.2	13%	0.133	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	130.5	-172.7	-60.8	129.5	0	0	0	109.6	R235 L236 H251 A255 W285 L290	R235-I253 CarbonylContact C-O 3.59Å; R235-I253 VanDerWaalsContact CA-O 3.28Å; R235-I253 WeakPolarHBondContact CA-O 3.45Å; R235-I253 WeakPolarHBondContact CD-O 3.36Å; L236-I253 HydrophobicContact CB-CB 4.48Å; L236-I253 HydrophobicContact CD2-CD1 3.92Å; L236-I253 PolarHBondContact N-O 3.42Å; L236-I253 PolarHBondContact O-N 3.03Å; H251-I253 HydrophobicContact CB-CD1 3.75Å; H251-I253 HydrophobicContact CB-CG1 4.49Å; I253-A255 HydrophobicContact CG2-CB 4.32Å; I253-A255 PolarHBondContact O-N 2.98Å; I253-A255 VanDerWaalsContact O-N 3.11Å; I253-W285 HydrophobicContact CG2-CH2 4.3Å; I253-W285 HydrophobicContact CG2-CZ3 4.23Å; I253-L290 HydrophobicContact CD1-CB 3.49Å; I253-L290 VanDerWaalsContact CD1-CB 3.49Å; I253-L290 HydrophobicContact CD1-CD1 3.68Å; I253-L290 HydrophobicContact CD1-CD2 4.27Å; I253-L290 HydrophobicContact CD1-CG 4Å; I253-L290 HydrophobicContact CG1-CB 4.15Å
254	E	97.6	Very high	92.9	Very high	123 Å²	123	68.1 Å²	68.1	58%	0.575	32%	0.315	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.2	92	164.5	-163.1	165.3	154.6	0	0	108.9	R235	R235-E254 IonicContact CZ-OE2 3.07Å; R235-E254 IonicContact NE-OE2 2.76Å; R235-E254 IonicContact NH2-OE2 2.95Å; R235-E254 PolarHBondContact NH2-OE2 2.77Å
255	A	97.2	Very high	93.9	Very high	2 Å²	2	57.8 Å²	57.8	2%	0.017	28%	0.276	C	S	.	.			trans	-85.4	-29.3	-166.9	0	0	0	0	0	112.8	K234 L236 I253 I260 W285 K293	K234-A255 PolarHBondContact O-N 3.38Å; L236-A255 HydrophobicContact CB-CB 3.73Å; L236-A255 HydrophobicContact CD1-CB 4.42Å; I253-A255 HydrophobicContact CG2-CB 4.32Å; I253-A255 PolarHBondContact O-N 2.98Å; I253-A255 VanDerWaalsContact O-N 3.11Å; A255-I260 HydrophobicContact CB-CD1 3.8Å; A255-W285 HydrophobicContact CB-CH2 3.77Å; A255-W285 HydrophobicContact CB-CZ2 3.45Å; A255-W285 VanDerWaalsContact CB-CZ2 3.45Å; A255-K293 WeakPolarHBondContact O-CE 3.34Å; A255-K293 PolarHBondContact O-NZ 2.63Å
256	H	98.2	Very high	94.9	Very high	5 Å²	5	54.3 Å²	54.3	2%	0.023	26%	0.256	C	S	.	.			trans	-138.3	165	-175.4	-76.7	-93.6	0	0	0	111.4	K234 E258 I260 T275 S277 D279 N281 C283	K234-H256 WeakPolarHBondContact CB-O 3.47Å; H256-E258 WeakPolarHBondContact CB-O 3.19Å; H256-I260 HydrophobicContact CB-CD1 4.37Å; H256-I260 HydrophobicContact CB-CG1 3.85Å; H256-T275 PolarHBondContact NE2-OG1 2.86Å; H256-S277 VanDerWaalsContact CG-CB 3.45Å; H256-S277 WeakPolarHBondContact ND1-CB 3.44Å; H256-D279 VanDerWaalsContact CB-OD2 3.24Å; H256-D279 WeakPolarHBondContact CB-OD2 3.45Å; H256-D279 IonicContact CE1-OD1 3.18Å; H256-D279 IonicContact CG-OD2 3.83Å; H256-D279 VanDerWaalsContact ND1-CG 3.33Å; H256-D279 IonicContact ND1-OD1 3.22Å; H256-D279 PolarHBondContact ND1-OD1 2.97Å; H256-D279 IonicContact ND1-OD2 3Å; H256-D279 PolarHBondContact ND1-OD2 3.27Å; H256-N281 PolarHBondContact CE1-O 3.47Å; H256-C283 PolarHBondContact CE1-SG 3.07Å
257	I	97.7	Very high	95.8	Very high	127 Å²	127	53.4 Å²	53.4	65%	0.651	26%	0.261	S	S	*	.	S	Bend	trans	-92.4	-8.8	176.7	62	171	0	0	0	112.8	K234 D279	K234-I257 VanDerWaalsContact CD-O 3.32Å; K234-I257 WeakPolarHBondContact CD-O 3.2Å; K234-I257 VanDerWaalsContact CE-O 3.31Å; K234-I257 WeakPolarHBondContact CE-O 3.36Å; K234-I257 PolarHBondContact NZ-O 3.4Å; I257-D279 HydrophobicContact CD1-CB 4.28Å; I257-D279 HydrophobicContact CG1-CB 3.56Å; I257-D279 PolarHBondContact N-OD2 3.05Å; I257-D279 VanDerWaalsContact N-OD2 3.17Å
258	E	98.1	Very high	96.5	Very high	83 Å²	83	48.6 Å²	48.6	39%	0.388	24%	0.243	S	C	.	.	S	Bend	trans	-135.6	166.5	173.6	-76.4	-60.7	120	0	0	110.7	K234 H256 I260 S277 N278 D279	K234-E258 IonicContact NZ-OE1 2.83Å; K234-E258 PolarHBondContact NZ-OE1 3.28Å; H256-E258 WeakPolarHBondContact CB-O 3.19Å; E258-I260 PolarHBondContact O-N 3.45Å; E258-S277 PolarHBondContact O-OG 3.07Å; E258-N278 HydrophobicContact CB-CB 4.05Å; E258-D279 HydrophobicContact CB-CB 3.86Å; E258-D279 HydrophobicContact CG-CB 4.28Å
259	P	97	Very high	96.7	Very high	21 Å²	21	42.8 Å²	42.8	14%	0.136	23%	0.226	C	C	.	.			trans	-45.3	129.9	-178.7	-37.5	41.4	0	0	0	115	D232 S277 N278	D232-P259 HydrophobicContact CB-CB 4.43Å; D232-P259 HydrophobicContact CB-CG 4.5Å; D232-P259 WeakPolarHBondContact OD1-CB 3.39Å; P259-S277 WeakPolarHBondContact O-CA 3.15Å; P259-S277 PolarHBondContact O-OG 3.26Å; P259-N278 PolarHBondContact O-N 2.97Å
260	I	97.8	Very high	96.8	Very high	0 Å²	0	45 Å²	45	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	122.2	179.5	-49.8	170.5	0	0	0	108.2	R215 V230 A231 A255 H256 E258 G276	R215-I260 VanDerWaalsContact CB-O 3.23Å; R215-I260 WeakPolarHBondContact CB-O 3.06Å; R215-I260 VanDerWaalsContact CG-O 3.27Å; R215-I260 WeakPolarHBondContact CG-O 3.04Å; V230-I260 HydrophobicContact CB-CB 3.85Å; V230-I260 HydrophobicContact CB-CD1 4.4Å; V230-I260 HydrophobicContact CB-CG2 3.55Å; V230-I260 HydrophobicContact CG1-CB 4.46Å; V230-I260 HydrophobicContact CG1-CD1 4.4Å; V230-I260 HydrophobicContact CG1-CG2 3.81Å; V230-I260 HydrophobicContact CG2-CB 4.39Å; V230-I260 HydrophobicContact CG2-CG2 3.86Å; A231-I260 PolarHBondContact O-N 3.22Å; A255-I260 HydrophobicContact CB-CD1 3.8Å; H256-I260 HydrophobicContact CB-CD1 4.37Å; H256-I260 HydrophobicContact CB-CG1 3.85Å; E258-I260 PolarHBondContact O-N 3.45Å; I260-G276 WeakPolarHBondContact CG2-O 3.4Å
261	Q	95.6	Very high	96.9	Very high	37 Å²	37	46 Å²	46	17%	0.173	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	-31.5	-173.2	-64.2	-54.5	-51.3	0	0	113.5	G276 N278 I304	Q261-G276 PolarHBondContact N-O 3.06Å; Q261-N278 WeakPolarHBondContact CG-OD1 3.42Å; Q261-N278 PolarHBondContact NE2-ND2 2.8Å; Q261-N278 PolarHBondContact NE2-OD1 2.95Å; Q261-I304 WeakPolarHBondContact CB-O 2.96Å; Q261-I304 WeakPolarHBondContact CG-O 3.37Å
262	C	96	Very high	96.9	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.9	156.2	-173	56.7	0	0	0	0	113.3	D216 T275 G276 K306 I307	D216-C262 WeakPolarHBondContact OD2-CA 3.19Å; D216-C262 WeakPolarHBondContact OD2-CB 3.37Å; C262-T275 WeakPolarHBondContact O-CA 3.28Å; C262-G276 PolarHBondContact N-O 3.25Å; C262-G276 PolarHBondContact O-N 2.76Å; C262-K306 HydrophobicContact CB-CD 4.17Å; C262-K306 VanDerWaalsContact SG-CA 3.56Å; C262-I307 PolarHBondContact SG-N 2.83Å
263	V	97.7	Very high	97	Very high	6 Å²	6	39 Å²	39	4%	0.036	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	140.5	175.5	60.6	0	0	0	0	110.4	D216 A218 V228 V230 F273 A274 T275	D216-V263 HydrophobicContact CB-CG1 4.26Å; D216-V263 PolarHBondContact OD2-N 2.83Å; A218-V263 HydrophobicContact CB-CG1 3.92Å; V228-V263 HydrophobicContact CB-CG2 4.36Å; V228-V263 HydrophobicContact CG1-CG2 3.84Å; V230-V263 HydrophobicContact CG1-CB 3.96Å; V230-V263 HydrophobicContact CG1-CG1 4.25Å; V230-V263 HydrophobicContact CG1-CG2 4.47Å; V230-V263 HydrophobicContact CG2-CB 4.07Å; V230-V263 HydrophobicContact CG2-CG1 3.92Å; V263-F273 HydrophobicContact CG2-CD2 4.05Å; V263-A274 WeakPolarHBondContact CA-O 3.16Å; V263-T275 HydrophobicContact CB-CG2 4.27Å; V263-T275 HydrophobicContact CG2-CG2 4.01Å
264	A	97.6	Very high	97	Very high	13 Å²	13	37.8 Å²	37.8	11%	0.107	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	125.8	177.8	0	0	0	0	0	111.7	F273 A274 I307 W309	A264-F273 CarbonylContact O-C 3.4Å; A264-F273 WeakPolarHBondContact O-CA 3.19Å; A264-F273 WeakPolarHBondContact O-CB 3.42Å; A264-A274 PolarHBondContact N-O 3.31Å; A264-A274 PolarHBondContact O-N 2.76Å; A264-I307 HydrophobicContact CB-CB 4.48Å; A264-I307 HydrophobicContact CB-CG2 4.12Å; A264-W309 PolarHBondContact O-NE1 3.01Å
265	F	98	Very high	97.1	Very high	13 Å²	13	32 Å²	32	6%	0.057	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	142.5	171.2	-80.5	-75.5	0	0	0	111.3	A218 W219 H220 L221 V228 F273 L287 W309	A218-F265 HydrophobicContact CB-CD2 3.89Å; A218-F265 HydrophobicContact CB-CE2 4.13Å; A218-F265 WeakPolarHBondContact O-CE2 3.23Å; W219-F265 WeakPolarHBondContact O-CD2 3.42Å; H220-F265 HydrophobicContact CB-CE2 4.19Å; H220-F265 HydrophobicContact CB-CZ 4.14Å; H220-F265 AromaticContact CD2-CD1 3.78Å; H220-F265 AromaticContact CD2-CE1 3.43Å; H220-F265 VanDerWaalsContact CD2-CE1 3.43Å; H220-F265 WeakPolarHBondContact CD2-CE1 3.27Å; H220-F265 AromaticContact CD2-CZ 3.83Å; L221-F265 HydrophobicContact CD1-CB 4.01Å; L221-F265 HydrophobicContact CG-CB 3.89Å; V228-F265 HydrophobicContact CB-CE2 4.19Å; V228-F265 HydrophobicContact CB-CZ 4.17Å; V228-F265 HydrophobicContact CG2-CE1 4.47Å; V228-F265 HydrophobicContact CG2-CE2 4.04Å; V228-F265 HydrophobicContact CG2-CZ 3.52Å; F265-F273 HydrophobicContact CD1-CB 3.63Å; F265-F273 HydrophobicContact CD1-CD1 4.39Å; F265-F273 HydrophobicContact CD1-CG 4.31Å; F265-F273 HydrophobicContact CE1-CB 3.96Å; F265-F273 AromaticContact CE1-CD1 3.94Å; F265-F273 HydrophobicContact CE1-CD1 3.94Å; F265-F273 HydrophobicContact CE1-CG 4.13Å; F265-F273 HydrophobicContact CG-CB 4.16Å; F265-L287 HydrophobicContact CE1-CD1 3.87Å; F265-L287 HydrophobicContact CE1-CG 4.44Å; F265-W309 PolarHBondContact O-NE1 3.17Å
266	S	96.4	Very high	97.1	Very high	8 Å²	8	31.9 Å²	31.9	6%	0.056	16%	0.162	C	C	.	.			trans	-71.6	131.4	171.8	-176.9	0	0	0	0	110	Y268 V272	S266-Y268 PolarHBondContact O-N 3.07Å; S266-Y268 PolarHBondContact OG-N 3.39Å; S266-V272 VanDerWaalsContact CB-O 3.25Å; S266-V272 WeakPolarHBondContact CB-O 3.3Å; S266-V272 PolarHBondContact N-O 2.84Å
267	P	95.2	Very high	97	Very high	65 Å²	65	31.6 Å²	31.6	42%	0.422	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.7	-10.2	173.9	28.2	-30.9	0	0	0	113.3	L221 W309	L221-P267 HydrophobicContact CD1-CB 3.99Å; P267-W309 HydrophobicContact CG-CB 4.22Å
268	Y	94.9	Very high	97	Very high	86 Å²	86	28.4 Å²	28.4	34%	0.337	15%	0.145	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.9	-10.5	-176.3	-53	-80.9	0	0	0	113.9	S266 C310 P311 H312 D313 E314	S266-Y268 PolarHBondContact O-N 3.07Å; S266-Y268 PolarHBondContact OG-N 3.39Å; Y268-C310 VanDerWaalsContact CE2-O 3.27Å; Y268-C310 WeakPolarHBondContact CE2-O 3.49Å; Y268-C310 PolarHBondContact OH-O 3.38Å; Y268-P311 PolarHBondContact OH-O 3.06Å; Y268-P311 VanDerWaalsContact OH-O 3.05Å; Y268-H312 VanDerWaalsContact OH-CA 3.31Å; Y268-H312 WeakPolarHBondContact OH-CA 3.43Å; Y268-H312 PolarHBondContact OH-N 3.29Å; Y268-D313 PolarHBondContact OH-N 3.3Å; Y268-E314 HydrophobicContact CD1-CB 3.85Å; Y268-E314 HydrophobicContact CD2-CB 3.38Å; Y268-E314 HydrophobicContact CE1-CB 4.23Å; Y268-E314 HydrophobicContact CE2-CB 3.8Å; Y268-E314 HydrophobicContact CG-CB 3.39Å
269	S	95.6	Very high	96.9	Very high	36 Å²	36	25.3 Å²	25.3	25%	0.252	13%	0.131	S	C	.	.			trans	-142.3	127	-177.2	175.6	0	0	0	0	111.1	Y271 V272	S269-Y271 PolarHBondContact O-N 2.72Å; S269-Y271 VanDerWaalsContact O-N 3.14Å; S269-Y271 PolarHBondContact OG-N 3.34Å; S269-V272 WeakPolarHBondContact OG-CG2 3.18Å; S269-V272 PolarHBondContact OG-N 3.14Å
270	E	96.5	Very high	96.9	Very high	64 Å²	64	28 Å²	28	30%	0.299	14%	0.142	S	C	.	.	S	Bend	trans	-70	-3.4	174.7	67.7	172.3	151.4	0	0	113.8	H220 I222 H223	H220-E270 PolarHBondContact NE2-O 3.48Å; I222-E270 HydrophobicContact CD1-CB 3.73Å; H223-E270 IonicContact CE1-OE2 2.97Å; H223-E270 IonicContact NE2-OE2 2.7Å; H223-E270 PolarHBondContact NE2-OE2 2.77Å
271	Y	97.2	Very high	96.8	Very high	77 Å²	77	29.6 Å²	29.6	30%	0.302	15%	0.151	S	C	.	.	S	Bend	trans	-117	-20.8	-177	-55.3	-62.7	0	0	0	112.9	S269 D286 L287 R288	S269-Y271 PolarHBondContact O-N 2.72Å; S269-Y271 VanDerWaalsContact O-N 3.14Å; S269-Y271 PolarHBondContact OG-N 3.34Å; Y271-D286 CarbonylContact O-C 3.56Å; Y271-D286 WeakPolarHBondContact O-CA 3.48Å; Y271-L287 PolarHBondContact O-N 2.84Å; Y271-R288 HydrophobicContact CD1-CG 3.36Å; Y271-R288 HydrophobicContact CE1-CG 3.65Å; Y271-R288 HydrophobicContact CG-CG 3.88Å
272	V	97.1	Very high	96.9	Very high	28 Å²	28	27.9 Å²	27.9	17%	0.17	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	134.4	-170.3	178	0	0	0	0	111.1	S266 S269 W285 L294 W309	S266-V272 VanDerWaalsContact CB-O 3.25Å; S266-V272 WeakPolarHBondContact CB-O 3.3Å; S266-V272 PolarHBondContact N-O 2.84Å; S269-V272 WeakPolarHBondContact OG-CG2 3.18Å; S269-V272 PolarHBondContact OG-N 3.14Å; V272-W285 WeakPolarHBondContact CA-O 3.31Å; V272-L294 HydrophobicContact CG2-CD1 4.11Å; V272-W309 HydrophobicContact CG1-CH2 3.86Å; V272-W309 HydrophobicContact CG1-CZ2 4.05Å
273	F	98	Very high	97	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	163	168.8	65.4	-87	0	0	0	110.3	L236 V263 A264 F265 T275 W285 L287 L290	L236-F273 HydrophobicContact CD1-CE2 3.39Å; L236-F273 HydrophobicContact CD1-CZ 3.84Å; L236-F273 HydrophobicContact CD2-CZ 4.38Å; V263-F273 HydrophobicContact CG2-CD2 4.05Å; A264-F273 CarbonylContact O-C 3.4Å; A264-F273 WeakPolarHBondContact O-CA 3.19Å; A264-F273 WeakPolarHBondContact O-CB 3.42Å; F265-F273 HydrophobicContact CD1-CB 3.63Å; F265-F273 HydrophobicContact CD1-CD1 4.39Å; F265-F273 HydrophobicContact CD1-CG 4.31Å; F265-F273 HydrophobicContact CE1-CB 3.96Å; F265-F273 AromaticContact CE1-CD1 3.94Å; F265-F273 HydrophobicContact CE1-CD1 3.94Å; F265-F273 HydrophobicContact CE1-CG 4.13Å; F265-F273 HydrophobicContact CG-CB 4.16Å; F273-T275 HydrophobicContact CD2-CG2 4.31Å; F273-T275 HydrophobicContact CE2-CG2 4.14Å; F273-W285 HydrophobicContact CD1-CB 4.06Å; F273-W285 HydrophobicContact CD2-CB 4.04Å; F273-W285 AromaticContact CD2-CD1 3.93Å; F273-W285 HydrophobicContact CD2-CG 4.26Å; F273-W285 HydrophobicContact CE1-CB 3.53Å; F273-W285 HydrophobicContact CE1-CG 4.42Å; F273-W285 HydrophobicContact CE2-CB 3.47Å; F273-W285 VanDerWaalsContact CE2-CB 3.47Å; F273-W285 AromaticContact CE2-CD1 3.42Å; F273-W285 VanDerWaalsContact CE2-CD1 3.42Å; F273-W285 HydrophobicContact CE2-CD2 4.49Å; F273-W285 AromaticContact CE2-CG 3.52Å; F273-W285 HydrophobicContact CE2-CG 3.52Å; F273-W285 HydrophobicContact CG-CB 4.3Å; F273-W285 HydrophobicContact CZ-CB 3.23Å; F273-W285 HydrophobicContact CZ-CD2 4.5Å; F273-W285 AromaticContact CZ-CG 3.65Å; F273-W285 HydrophobicContact CZ-CG 3.65Å; F273-W285 PolarHBondContact N-O 3.33Å; F273-W285 PolarHBondContact O-N 2.96Å; F273-L287 HydrophobicContact CD1-CD2 4.1Å; F273-L287 HydrophobicContact CD1-CG 3.94Å; F273-L287 HydrophobicContact CE1-CD2 3.57Å; F273-L287 HydrophobicContact CE1-CG 3.77Å; F273-L290 HydrophobicContact CE1-CD2 3.8Å; F273-L290 HydrophobicContact CZ-CD2 3.68Å
274	A	98.2	Very high	97	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	146.8	-178.6	0	0	0	0	0	111	V263 A264 C283 L284 I307 W309 L317	V263-A274 WeakPolarHBondContact CA-O 3.16Å; A264-A274 PolarHBondContact N-O 3.31Å; A264-A274 PolarHBondContact O-N 2.76Å; A274-C283 CarbonylContact C-O 3.54Å; A274-C283 VanDerWaalsContact CA-O 3.25Å; A274-C283 WeakPolarHBondContact CA-O 3.42Å; A274-L284 HydrophobicContact CB-CD2 3.72Å; A274-I307 HydrophobicContact CB-CD1 4.28Å; A274-I307 HydrophobicContact CB-CG2 3.99Å; A274-W309 HydrophobicContact CB-CZ2 4.02Å; A274-L317 HydrophobicContact CB-CD1 4.35Å; A274-L317 HydrophobicContact CB-CD2 4.19Å
275	T	98.3	Very high	97	Very high	0 Å²	0	28 Å²	28	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	147	170.3	56	0	0	0	0	111.1	V230 L236 H256 C262 V263 F273 T282 C283 W285 I307	V230-T275 HydrophobicContact CG1-CG2 4.16Å; L236-T275 HydrophobicContact CD1-CG2 3.63Å; H256-T275 PolarHBondContact NE2-OG1 2.86Å; C262-T275 WeakPolarHBondContact O-CA 3.28Å; V263-T275 HydrophobicContact CB-CG2 4.27Å; V263-T275 HydrophobicContact CG2-CG2 4.01Å; F273-T275 HydrophobicContact CD2-CG2 4.31Å; F273-T275 HydrophobicContact CE2-CG2 4.14Å; T275-T282 CarbonylContact O-C 3.52Å; T275-T282 VanDerWaalsContact O-CA 3.27Å; T275-T282 WeakPolarHBondContact O-CA 3.48Å; T275-C283 PolarHBondContact N-O 3Å; T275-C283 PolarHBondContact O-N 2.93Å; T275-W285 PolarHBondContact OG1-NE1 3.16Å; T275-I307 WeakPolarHBondContact O-CD1 3.23Å
276	G	97.2	Very high	97	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	135.6	-179.9	0	0	0	0	0	110.3	I260 Q261 C262 I307	I260-G276 WeakPolarHBondContact CG2-O 3.4Å; Q261-G276 PolarHBondContact N-O 3.06Å; C262-G276 PolarHBondContact N-O 3.25Å; C262-G276 PolarHBondContact O-N 2.76Å; G276-I307 VanDerWaalsContact CA-CD1 3.43Å
277	S	97.6	Very high	97.1	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	166.2	-171.6	169.5	0	0	0	0	112.8	H256 E258 P259 D279 E280 N281 I304	H256-S277 VanDerWaalsContact CG-CB 3.45Å; H256-S277 WeakPolarHBondContact ND1-CB 3.44Å; E258-S277 PolarHBondContact O-OG 3.07Å; P259-S277 WeakPolarHBondContact O-CA 3.15Å; P259-S277 PolarHBondContact O-OG 3.26Å; S277-D279 WeakPolarHBondContact CB-OD1 3.4Å; S277-D279 PolarHBondContact O-N 3Å; S277-D279 PolarHBondContact OG-N 2.85Å; S277-D279 VanDerWaalsContact OG-N 3.08Å; S277-D279 PolarHBondContact OG-OD1 3.26Å; S277-E280 PolarHBondContact O-N 3.32Å; S277-N281 PolarHBondContact N-O 3.28Å; S277-I304 PolarHBondContact O-N 3.2Å
278	N	96.9	Very high	97.1	Very high	59 Å²	59	34.1 Å²	34.1	32%	0.316	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-8.2	167.3	-71.6	-6.2	0	0	0	113.4	E258 P259 Q261 E280	E258-N278 HydrophobicContact CB-CB 4.05Å; P259-N278 PolarHBondContact O-N 2.97Å; Q261-N278 WeakPolarHBondContact CG-OD1 3.42Å; Q261-N278 PolarHBondContact NE2-ND2 2.8Å; Q261-N278 PolarHBondContact NE2-OD1 2.95Å; N278-E280 PolarHBondContact O-N 3.27Å
279	D	97	Very high	97.2	Very high	18 Å²	18	33.7 Å²	33.7	10%	0.096	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.6	13.5	168.9	66.3	11.2	0	0	0	112.9	H256 I257 E258 S277 N281	H256-D279 VanDerWaalsContact CB-OD2 3.24Å; H256-D279 WeakPolarHBondContact CB-OD2 3.45Å; H256-D279 IonicContact CE1-OD1 3.18Å; H256-D279 IonicContact CG-OD2 3.83Å; H256-D279 VanDerWaalsContact ND1-CG 3.33Å; H256-D279 IonicContact ND1-OD1 3.22Å; H256-D279 PolarHBondContact ND1-OD1 2.97Å; H256-D279 IonicContact ND1-OD2 3Å; H256-D279 PolarHBondContact ND1-OD2 3.27Å; I257-D279 HydrophobicContact CD1-CB 4.28Å; I257-D279 HydrophobicContact CG1-CB 3.56Å; I257-D279 PolarHBondContact N-OD2 3.05Å; I257-D279 VanDerWaalsContact N-OD2 3.17Å; E258-D279 HydrophobicContact CB-CB 3.86Å; E258-D279 HydrophobicContact CG-CB 4.28Å; S277-D279 WeakPolarHBondContact CB-OD1 3.4Å; S277-D279 PolarHBondContact O-N 3Å; S277-D279 PolarHBondContact OG-N 2.85Å; S277-D279 VanDerWaalsContact OG-N 3.08Å; S277-D279 PolarHBondContact OG-OD1 3.26Å; D279-N281 PolarHBondContact O-N 3.08Å; D279-N281 PolarHBondContact O-ND2 2.97Å; D279-N281 VanDerWaalsContact OD1-CB 3.3Å; D279-N281 WeakPolarHBondContact OD1-CB 3.29Å; D279-N281 PolarHBondContact OD1-N 3.37Å
280	E	95.7	Very high	97.3	Very high	78 Å²	78	32.5 Å²	32.5	36%	0.364	15%	0.151	S	C	.	.	S	Bend	trans	64.7	9.7	177.5	-44.3	-177.7	159.8	0	0	112.8	S277 N278 N299	S277-E280 PolarHBondContact O-N 3.32Å; N278-E280 PolarHBondContact O-N 3.27Å; E280-N299 WeakPolarHBondContact O-CB 3.37Å; E280-N299 PolarHBondContact O-N 2.94Å
281	N	96.9	Very high	97.3	Very high	34 Å²	34	34.1 Å²	34.1	18%	0.182	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	139	178.9	-72.7	-88.1	0	0	0	112.4	H256 S277 D279 S296 M297	H256-N281 PolarHBondContact CE1-O 3.47Å; S277-N281 PolarHBondContact N-O 3.28Å; D279-N281 PolarHBondContact O-N 3.08Å; D279-N281 PolarHBondContact O-ND2 2.97Å; D279-N281 VanDerWaalsContact OD1-CB 3.3Å; D279-N281 WeakPolarHBondContact OD1-CB 3.29Å; D279-N281 PolarHBondContact OD1-N 3.37Å; N281-S296 PolarHBondContact OD1-OG 2.93Å; N281-S296 VanDerWaalsContact OD1-OG 3.08Å; N281-M297 WeakPolarHBondContact CA-O 3.45Å
282	T	97.2	Very high	97.2	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	120.2	160.3	-60.7	0	0	0	0	108.8	T275 M297 I307 L317 T319	T275-T282 CarbonylContact O-C 3.52Å; T275-T282 VanDerWaalsContact O-CA 3.27Å; T275-T282 WeakPolarHBondContact O-CA 3.48Å; T282-M297 HydrophobicContact CG2-CE 3.65Å; T282-M297 PolarHBondContact N-O 3.47Å; T282-M297 PolarHBondContact O-N 3.47Å; T282-I307 HydrophobicContact CG2-CD1 3.74Å; T282-I307 HydrophobicContact CG2-CG1 4.35Å; T282-L317 HydrophobicContact CG2-CD2 3.69Å; T282-T319 HydrophobicContact CG2-CG2 4.07Å; T282-T319 WeakPolarHBondContact OG1-CG2 3.24Å
283	C	97.8	Very high	97.2	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	135.9	-177.7	-67.9	0	0	0	0	111	H256 A274 T275 W285 K293 H295 S296	H256-C283 PolarHBondContact CE1-SG 3.07Å; A274-C283 CarbonylContact C-O 3.54Å; A274-C283 VanDerWaalsContact CA-O 3.25Å; A274-C283 WeakPolarHBondContact CA-O 3.42Å; T275-C283 PolarHBondContact N-O 3Å; T275-C283 PolarHBondContact O-N 2.93Å; C283-W285 HydrophobicContact CB-CZ2 4.05Å; C283-K293 HydrophobicContact CB-CD 4.11Å; C283-K293 HydrophobicContact CB-CG 4.44Å; C283-K293 VanDerWaalsContact SG-CD 3.58Å; C283-K293 VanDerWaalsContact SG-CE 3.55Å; C283-K293 PolarHBondContact SG-NZ 3.33Å; C283-H295 WeakPolarHBondContact CA-O 3.11Å; C283-S296 PolarHBondContact SG-OG 2.75Å
284	L	97.8	Very high	97.1	Very high	16 Å²	16	40.9 Å²	40.9	8%	0.084	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	141.2	171.6	-64.2	-176.7	0	0	0	110.3	A274 L294 H295 M297 W309 L317 L331	A274-L284 HydrophobicContact CB-CD2 3.72Å; L284-L294 HydrophobicContact CB-CB 4.01Å; L284-L294 PolarHBondContact O-N 2.94Å; L284-H295 HydrophobicContact CB-CB 4.25Å; L284-H295 HydrophobicContact CD1-CB 4.16Å; L284-H295 HydrophobicContact CG-CB 4.39Å; L284-H295 PolarHBondContact N-O 3.32Å; L284-M297 HydrophobicContact CG-CE 4.26Å; L284-W309 HydrophobicContact CD2-CH2 4.01Å; L284-W309 HydrophobicContact CD2-CZ2 3.99Å; L284-L317 HydrophobicContact CD2-CD2 4.47Å; L284-L331 HydrophobicContact CD1-CD1 4.11Å; L284-L331 HydrophobicContact CD1-CD2 3.89Å
285	W	98.4	Very high	96.9	Very high	7 Å²	7	45.8 Å²	45.8	3%	0.027	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	151	-174	-59.3	92.3	0	0	0	111.4	I253 A255 V272 F273 T275 C283 L290 K293	I253-W285 HydrophobicContact CG2-CH2 4.3Å; I253-W285 HydrophobicContact CG2-CZ3 4.23Å; A255-W285 HydrophobicContact CB-CH2 3.77Å; A255-W285 HydrophobicContact CB-CZ2 3.45Å; A255-W285 VanDerWaalsContact CB-CZ2 3.45Å; V272-W285 WeakPolarHBondContact CA-O 3.31Å; F273-W285 HydrophobicContact CD1-CB 4.06Å; F273-W285 HydrophobicContact CD2-CB 4.04Å; F273-W285 AromaticContact CD2-CD1 3.93Å; F273-W285 HydrophobicContact CD2-CG 4.26Å; F273-W285 HydrophobicContact CE1-CB 3.53Å; F273-W285 HydrophobicContact CE1-CG 4.42Å; F273-W285 HydrophobicContact CE2-CB 3.47Å; F273-W285 VanDerWaalsContact CE2-CB 3.47Å; F273-W285 AromaticContact CE2-CD1 3.42Å; F273-W285 VanDerWaalsContact CE2-CD1 3.42Å; F273-W285 HydrophobicContact CE2-CD2 4.49Å; F273-W285 AromaticContact CE2-CG 3.52Å; F273-W285 HydrophobicContact CE2-CG 3.52Å; F273-W285 HydrophobicContact CG-CB 4.3Å; F273-W285 HydrophobicContact CZ-CB 3.23Å; F273-W285 HydrophobicContact CZ-CD2 4.5Å; F273-W285 AromaticContact CZ-CG 3.65Å; F273-W285 HydrophobicContact CZ-CG 3.65Å; F273-W285 PolarHBondContact N-O 3.33Å; F273-W285 PolarHBondContact O-N 2.96Å; T275-W285 PolarHBondContact OG1-NE1 3.16Å; C283-W285 HydrophobicContact CB-CZ2 4.05Å; W285-L290 HydrophobicContact CB-CD2 4.34Å; W285-K293 HydrophobicContact CE3-CG 4.25Å; W285-K293 HydrophobicContact CH2-CD 4.16Å; W285-K293 HydrophobicContact CH2-CG 3.43Å; W285-K293 VanDerWaalsContact CH2-CG 3.43Å; W285-K293 HydrophobicContact CZ2-CD 4.2Å; W285-K293 HydrophobicContact CZ2-CG 3.71Å; W285-K293 HydrophobicContact CZ3-CG 3.73Å
286	D	97.7	Very high	96.8	Very high	18 Å²	18	48.3 Å²	48.3	10%	0.096	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	119.3	169.8	-169.8	-35.6	0	0	0	108.9	Y271 R288 N289 L290 L294	Y271-D286 CarbonylContact O-C 3.56Å; Y271-D286 WeakPolarHBondContact O-CA 3.48Å; D286-R288 PolarHBondContact O-N 3Å; D286-R288 VanDerWaalsContact O-N 3.1Å; D286-R288 WeakPolarHBondContact OD1-CB 2.92Å; D286-R288 VanDerWaalsContact OD1-CG 3.32Å; D286-R288 WeakPolarHBondContact OD1-CG 3.49Å; D286-R288 IonicContact OD1-CZ 2.83Å; D286-R288 PolarHBondContact OD1-N 2.92Å; D286-R288 IonicContact OD1-NE 3.75Å; D286-R288 PolarHBondContact OD1-NE 3.41Å; D286-R288 IonicContact OD1-NH2 2.62Å; D286-R288 IonicContact OD2-CZ 3.7Å; D286-R288 IonicContact OD2-NE 3.79Å; D286-R288 PolarHBondContact OD2-NE 3.28Å; D286-R288 IonicContact OD2-NH2 3.83Å; D286-R288 PolarHBondContact OD2-NH2 2.9Å; D286-N289 CarbonylContact O-C 3.57Å; D286-N289 PolarHBondContact O-N 2.79Å; D286-L290 WeakPolarHBondContact O-CD2 3.33Å; D286-L290 PolarHBondContact O-N 3.17Å; D286-L294 HydrophobicContact CB-CD1 3.94Å; D286-L294 HydrophobicContact CB-CD2 4.02Å; D286-L294 HydrophobicContact CB-CG 3.99Å
287	L	97.3	Very high	96.7	Very high	28 Å²	28	48.8 Å²	48.8	15%	0.147	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.7	-25.2	177.6	-80.7	177.1	0	0	0	113.5	V238 F265 Y271 F273 N289 L290	V238-L287 HydrophobicContact CG1-CD2 4.18Å; V238-L287 HydrophobicContact CG2-CD2 4.2Å; F265-L287 HydrophobicContact CE1-CD1 3.87Å; F265-L287 HydrophobicContact CE1-CG 4.44Å; Y271-L287 PolarHBondContact O-N 2.84Å; F273-L287 HydrophobicContact CD1-CD2 4.1Å; F273-L287 HydrophobicContact CD1-CG 3.94Å; F273-L287 HydrophobicContact CE1-CD2 3.57Å; F273-L287 HydrophobicContact CE1-CG 3.77Å; L287-N289 VanDerWaalsContact C-N 3.32Å; L287-L290 HydrophobicContact CD2-CD1 4.47Å
288	R	96.6	Very high	96.6	Very high	168 Å²	168	55.1 Å²	55.1	63%	0.634	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.4	-23.5	178	-54.5	171.8	-65.2	-177.5	3.6	112	Y271 D286	Y271-R288 HydrophobicContact CD1-CG 3.36Å; Y271-R288 HydrophobicContact CE1-CG 3.65Å; Y271-R288 HydrophobicContact CG-CG 3.88Å; D286-R288 PolarHBondContact O-N 3Å; D286-R288 VanDerWaalsContact O-N 3.1Å; D286-R288 WeakPolarHBondContact OD1-CB 2.92Å; D286-R288 VanDerWaalsContact OD1-CG 3.32Å; D286-R288 WeakPolarHBondContact OD1-CG 3.49Å; D286-R288 IonicContact OD1-CZ 2.83Å; D286-R288 PolarHBondContact OD1-N 2.92Å; D286-R288 IonicContact OD1-NE 3.75Å; D286-R288 PolarHBondContact OD1-NE 3.41Å; D286-R288 IonicContact OD1-NH2 2.62Å; D286-R288 IonicContact OD2-CZ 3.7Å; D286-R288 IonicContact OD2-NE 3.79Å; D286-R288 PolarHBondContact OD2-NE 3.28Å; D286-R288 IonicContact OD2-NH2 3.83Å; D286-R288 PolarHBondContact OD2-NH2 2.9Å
289	N	97.1	Very high	96.2	Very high	76 Å²	76	52.4 Å²	52.4	41%	0.406	27%	0.267	S	S	.	.	B	Isolated β-bridge	trans	-147.3	86.4	178.8	-175.6	16.1	0	0	0	111.8	D286 L287 S291	D286-N289 CarbonylContact O-C 3.57Å; D286-N289 PolarHBondContact O-N 2.79Å; L287-N289 VanDerWaalsContact C-N 3.32Å; N289-S291 VanDerWaalsContact C-N 3.25Å; N289-S291 PolarHBondContact O-N 2.83Å; N289-S291 PolarHBondContact OD1-N 2.8Å; N289-S291 PolarHBondContact OD1-OG 2.79Å
290	L	97.4	Very high	95.7	Very high	11 Å²	11	56 Å²	56	6%	0.058	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.4	3.6	-179.9	-63.1	164.9	0	0	0	113.9	V238 H251 I253 F273 W285 D286 L287 V292	V238-L290 HydrophobicContact CG2-CD1 3.63Å; H251-L290 HydrophobicContact CB-CD1 3.94Å; I253-L290 HydrophobicContact CD1-CB 3.49Å; I253-L290 VanDerWaalsContact CD1-CB 3.49Å; I253-L290 HydrophobicContact CD1-CD1 3.68Å; I253-L290 HydrophobicContact CD1-CD2 4.27Å; I253-L290 HydrophobicContact CD1-CG 4Å; I253-L290 HydrophobicContact CG1-CB 4.15Å; F273-L290 HydrophobicContact CE1-CD2 3.8Å; F273-L290 HydrophobicContact CZ-CD2 3.68Å; W285-L290 HydrophobicContact CB-CD2 4.34Å; D286-L290 WeakPolarHBondContact O-CD2 3.33Å; D286-L290 PolarHBondContact O-N 3.17Å; L287-L290 HydrophobicContact CD2-CD1 4.47Å; L290-V292 VanDerWaalsContact C-N 3.27Å
291	S	95	Very high	95.3	Very high	99 Å²	99	56.7 Å²	56.7	69%	0.692	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.1	-17.5	178	70.3	0	0	0	0	113.2	N289	N289-S291 VanDerWaalsContact C-N 3.25Å; N289-S291 PolarHBondContact O-N 2.83Å; N289-S291 PolarHBondContact OD1-N 2.8Å; N289-S291 PolarHBondContact OD1-OG 2.79Å
292	V	95.8	Very high	95.1	Very high	80 Å²	80	55.3 Å²	55.3	49%	0.485	29%	0.288	S	S	.	.	S	Bend	trans	-136.7	147.3	179.7	-62.9	0	0	0	0	110.3	L290	L290-V292 VanDerWaalsContact C-N 3.27Å
293	K	97	Very high	95	Very high	78 Å²	78	57.2 Å²	57.2	34%	0.339	30%	0.301	S	S	.	.			trans	-73.7	137.6	168.7	-64.5	173.5	177.7	-168.4	0	108.6	A255 C283 W285	A255-K293 WeakPolarHBondContact O-CE 3.34Å; A255-K293 PolarHBondContact O-NZ 2.63Å; C283-K293 HydrophobicContact CB-CD 4.11Å; C283-K293 HydrophobicContact CB-CG 4.44Å; C283-K293 VanDerWaalsContact SG-CD 3.58Å; C283-K293 VanDerWaalsContact SG-CE 3.55Å; C283-K293 PolarHBondContact SG-NZ 3.33Å; W285-K293 HydrophobicContact CE3-CG 4.25Å; W285-K293 HydrophobicContact CH2-CD 4.16Å; W285-K293 HydrophobicContact CH2-CG 3.43Å; W285-K293 VanDerWaalsContact CH2-CG 3.43Å; W285-K293 HydrophobicContact CZ2-CD 4.2Å; W285-K293 HydrophobicContact CZ2-CG 3.71Å; W285-K293 HydrophobicContact CZ3-CG 3.73Å
294	L	96	Very high	94.9	Very high	88 Å²	88	57.2 Å²	57.2	46%	0.461	30%	0.301	S	S	.	.	S	Bend	trans	-66.1	-44.4	168	-72	178.4	0	0	0	110.2	V272 L284 D286	V272-L294 HydrophobicContact CG2-CD1 4.11Å; L284-L294 HydrophobicContact CB-CB 4.01Å; L284-L294 PolarHBondContact O-N 2.94Å; D286-L294 HydrophobicContact CB-CD1 3.94Å; D286-L294 HydrophobicContact CB-CD2 4.02Å; D286-L294 HydrophobicContact CB-CG 3.99Å
295	H	95.3	Very high	94.7	Very high	103 Å²	103	58.4 Å²	58.4	48%	0.477	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.4	156.7	178.8	-161.2	52	0	0	0	111	C283 L284 M297	C283-H295 WeakPolarHBondContact CA-O 3.11Å; L284-H295 HydrophobicContact CB-CB 4.25Å; L284-H295 HydrophobicContact CD1-CB 4.16Å; L284-H295 HydrophobicContact CG-CB 4.39Å; L284-H295 PolarHBondContact N-O 3.32Å; H295-M297 WeakPolarHBondContact CD2-CG 3.48Å
296	S	95.7	Very high	94.5	Very high	53 Å²	53	61.3 Å²	61.3	37%	0.371	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	119.4	172.6	-166	0	0	0	0	108	N281 C283	N281-S296 PolarHBondContact OD1-OG 2.93Å; N281-S296 VanDerWaalsContact OD1-OG 3.08Å; C283-S296 PolarHBondContact SG-OG 2.75Å
297	M	95.5	Very high	94.4	Very high	11 Å²	11	60.6 Å²	60.6	5%	0.054	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	115	-178.4	-62	174.1	-66.3	0	0	108.4	N281 T282 L284 H295 L317 W329 L331	N281-M297 WeakPolarHBondContact CA-O 3.45Å; T282-M297 HydrophobicContact CG2-CE 3.65Å; T282-M297 PolarHBondContact N-O 3.47Å; T282-M297 PolarHBondContact O-N 3.47Å; L284-M297 HydrophobicContact CG-CE 4.26Å; H295-M297 WeakPolarHBondContact CD2-CG 3.48Å; M297-L317 HydrophobicContact CE-CD2 3.82Å; M297-W329 HydrophobicContact CB-CD2 4.35Å; M297-W329 HydrophobicContact CB-CE3 3.95Å; M297-W329 HydrophobicContact CB-CH2 3.94Å; M297-W329 HydrophobicContact CB-CZ2 4.33Å; M297-W329 HydrophobicContact CB-CZ3 3.74Å; M297-W329 HydrophobicContact CE-CG 4.43Å; M297-W329 HydrophobicContact CG-CE3 4.14Å; M297-W329 HydrophobicContact CG-CZ3 4.31Å; M297-W329 HydrophobicContact SD-CB 4.12Å; M297-W329 HydrophobicContact SD-CD2 3.88Å; M297-W329 HydrophobicContact SD-CE3 3.73Å; M297-W329 HydrophobicContact SD-CG 4.05Å; M297-W329 HydrophobicContact SD-CZ3 4.46Å; M297-L331 HydrophobicContact CE-CD2 3.99Å; M297-L331 HydrophobicContact SD-CD2 3.7Å
298	E	93.8	Very high	94.3	Very high	133 Å²	133	64.5 Å²	64.5	62%	0.621	34%	0.342	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.6	122.3	177.2	-175.5	178	-178.4	0	0	109.6	P300 W329	E298-P300 WeakPolarHBondContact O-CD 3.28Å; E298-W329 WeakPolarHBondContact O-CH2 3.32Å
299	N	89.7	Confident	94.3	Very high	2 Å²	2	57.2 Å²	57.2	1%	0.011	32%	0.315	C	S	.	.			trans	-90.9	106.4	173.8	-173.7	-36.6	0	0	0	109.1	E280 E301 G302 I304 T319 Q327 W329	E280-N299 WeakPolarHBondContact O-CB 3.37Å; E280-N299 PolarHBondContact O-N 2.94Å; N299-E301 PolarHBondContact O-N 2.86Å; N299-E301 VanDerWaalsContact O-N 3.11Å; N299-E301 WeakPolarHBondContact OD1-CB 3.37Å; N299-E301 PolarHBondContact OD1-N 3.49Å; N299-G302 PolarHBondContact O-N 2.88Å; N299-G302 VanDerWaalsContact O-N 3.15Å; N299-I304 HydrophobicContact CB-CD1 3.45Å; N299-I304 VanDerWaalsContact CB-CD1 3.45Å; N299-I304 WeakPolarHBondContact ND2-CD1 3.41Å; N299-T319 PolarHBondContact ND2-OG1 2.94Å; N299-Q327 PolarHBondContact ND2-OE1 3.5Å; N299-Q327 PolarHBondContact OD1-OE1 2.81Å; N299-W329 HydrophobicContact CB-CZ2 4.16Å
300	P	86	Confident	94.1	Very high	93 Å²	93	55.2 Å²	55.2	60%	0.604	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.4	-13.3	-174.3	29.4	-36.2	0	0	0	113.7	E298 G302	E298-P300 WeakPolarHBondContact O-CD 3.28Å; P300-G302 VanDerWaalsContact C-N 3.3Å
301	E	88.4	Confident	93.7	Very high	93 Å²	93	59 Å²	59	44%	0.435	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.5	-3.7	179.8	-55	-59.8	150.5	0	0	112.2	N299 N321 F325	N299-E301 PolarHBondContact O-N 2.86Å; N299-E301 VanDerWaalsContact O-N 3.11Å; N299-E301 WeakPolarHBondContact OD1-CB 3.37Å; N299-E301 PolarHBondContact OD1-N 3.49Å; E301-N321 PolarHBondContact O-ND2 3.24Å; E301-F325 HydrophobicContact CB-CB 4.21Å; E301-F325 HydrophobicContact CB-CD2 3.91Å; E301-F325 HydrophobicContact CB-CG 4.22Å; E301-F325 HydrophobicContact CG-CB 4.21Å; E301-F325 HydrophobicContact CG-CD2 4.03Å; E301-F325 HydrophobicContact CG-CG 4.03Å; E301-F325 WeakPolarHBondContact OE2-CE2 3.32Å
302	G	92.1	Very high	93.4	Very high	5 Å²	5	59.9 Å²	59.9	5%	0.052	33%	0.325	C	S	.	.			trans	114.9	-154.2	169.4	0	0	0	0	0	115.2	N299 P300 N321	N299-G302 PolarHBondContact O-N 2.88Å; N299-G302 VanDerWaalsContact O-N 3.15Å; P300-G302 VanDerWaalsContact C-N 3.3Å; G302-N321 WeakPolarHBondContact CA-ND2 3.31Å; G302-N321 PolarHBondContact N-ND2 3.12Å; G302-N321 PolarHBondContact O-ND2 2.83Å; G302-N321 VanDerWaalsContact O-ND2 3.09Å
303	P	94.7	Very high	93.2	Very high	40 Å²	40	58.7 Å²	58.7	26%	0.26	32%	0.316	S	S	.	.			trans	-53.1	141.7	-175	-32.3	38.6	0	0	0	115.7	N321 P322	P303-N321 WeakPolarHBondContact O-CA 3.5Å; P303-N321 PolarHBondContact O-ND2 3.11Å; P303-P322 WeakPolarHBondContact O-CD 3.29Å
304	I	95.4	Very high	93	Very high	0 Å²	0	60.2 Å²	60.2	0%	0	32%	0.324	C	S	.	.			trans	-86	122.5	176.7	-47.7	-57.4	0	0	0	110	Q261 S277 N299 I307 T319	Q261-I304 WeakPolarHBondContact CB-O 2.96Å; Q261-I304 WeakPolarHBondContact CG-O 3.37Å; S277-I304 PolarHBondContact O-N 3.2Å; N299-I304 HydrophobicContact CB-CD1 3.45Å; N299-I304 VanDerWaalsContact CB-CD1 3.45Å; N299-I304 WeakPolarHBondContact ND2-CD1 3.41Å; I304-I307 HydrophobicContact CG2-CD1 4.29Å; I304-I307 HydrophobicContact CG2-CG1 3.88Å; I304-T319 HydrophobicContact CG2-CG2 4.37Å
305	A	93.8	Very high	92.9	Very high	40 Å²	40	60.7 Å²	60.7	33%	0.331	32%	0.319	S	S	.	.			trans	-91.1	-41.5	176.4	0	0	0	0	0	113.1	S320 P322	A305-S320 PolarHBondContact N-O 2.69Å; A305-P322 HydrophobicContact CB-CG 4.1Å
306	K	93.9	Very high	92.8	Very high	69 Å²	69	58.3 Å²	58.3	30%	0.3	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.7	146.6	179.9	-160.5	69.7	-179.9	174.4	0	110.5	D216 C262 T319 S320	D216-K306 IonicContact OD1-NZ 3.24Å; D216-K306 PolarHBondContact OD1-NZ 2.94Å; D216-K306 IonicContact OD2-NZ 3.37Å; D216-K306 PolarHBondContact OD2-NZ 3.2Å; C262-K306 HydrophobicContact CB-CD 4.17Å; C262-K306 VanDerWaalsContact SG-CA 3.56Å; K306-T319 WeakPolarHBondContact O-CA 3.34Å; K306-S320 WeakPolarHBondContact CB-OG 3.43Å; K306-S320 PolarHBondContact N-OG 2.82Å; K306-S320 PolarHBondContact O-N 3.43Å; K306-S320 PolarHBondContact O-OG 3.44Å
307	I	95.4	Very high	92.8	Very high	3 Å²	3	55.8 Å²	55.8	2%	0.015	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	141	171	-68	162.7	0	0	0	108.4	C262 A264 A274 T275 G276 T282 I304 L317 A318 T319	C262-I307 PolarHBondContact SG-N 2.83Å; A264-I307 HydrophobicContact CB-CB 4.48Å; A264-I307 HydrophobicContact CB-CG2 4.12Å; A274-I307 HydrophobicContact CB-CD1 4.28Å; A274-I307 HydrophobicContact CB-CG2 3.99Å; T275-I307 WeakPolarHBondContact O-CD1 3.23Å; G276-I307 VanDerWaalsContact CA-CD1 3.43Å; T282-I307 HydrophobicContact CG2-CD1 3.74Å; T282-I307 HydrophobicContact CG2-CG1 4.35Å; I304-I307 HydrophobicContact CG2-CD1 4.29Å; I304-I307 HydrophobicContact CG2-CG1 3.88Å; I307-L317 HydrophobicContact CG2-CD1 3.51Å; I307-L317 HydrophobicContact CG2-CD2 4.13Å; I307-L317 HydrophobicContact CG2-CG 3.93Å; I307-A318 WeakPolarHBondContact CA-O 3.28Å; I307-T319 HydrophobicContact CG1-CG2 3.92Å
308	D	95.3	Very high	92.8	Very high	109 Å²	109	56.5 Å²	56.5	58%	0.583	30%	0.3	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-143.2	144.6	168.5	-158.3	16	0	0	0	110.9	A318	D308-A318 PolarHBondContact N-O 3.25Å; D308-A318 PolarHBondContact O-N 3.16Å
309	W	96.2	Very high	92.9	Very high	15 Å²	15	50.2 Å²	50.2	6%	0.057	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	143.1	177.3	-70.4	84.2	0	0	0	109.6	A264 F265 P267 V272 A274 L284 P311 L317 L331	A264-W309 PolarHBondContact O-NE1 3.01Å; F265-W309 PolarHBondContact O-NE1 3.17Å; P267-W309 HydrophobicContact CG-CB 4.22Å; V272-W309 HydrophobicContact CG1-CH2 3.86Å; V272-W309 HydrophobicContact CG1-CZ2 4.05Å; A274-W309 HydrophobicContact CB-CZ2 4.02Å; L284-W309 HydrophobicContact CD2-CH2 4.01Å; L284-W309 HydrophobicContact CD2-CZ2 3.99Å; W309-P311 WeakPolarHBondContact O-CD 3.24Å; W309-L317 HydrophobicContact CD2-CD1 3.49Å; W309-L317 VanDerWaalsContact CD2-CD1 3.49Å; W309-L317 HydrophobicContact CE3-CD1 3.97Å; W309-L317 HydrophobicContact CG-CD1 3.76Å; W309-L317 HydrophobicContact CH2-CD1 4.44Å; W309-L317 HydrophobicContact CZ2-CD1 4.03Å; W309-L317 HydrophobicContact CZ3-CD1 4.42Å; W309-L331 HydrophobicContact CH2-CD1 3.71Å; W309-L331 HydrophobicContact CZ3-CD1 3.47Å; W309-L331 VanDerWaalsContact CZ3-CD1 3.47Å
310	C	93.7	Very high	93.1	Very high	34 Å²	34	51.8 Å²	51.8	23%	0.23	28%	0.282	C	S	.	.			trans	-66.3	124.6	172	-177.1	0	0	0	0	109.8	Y268 H312 D313 I316	Y268-C310 VanDerWaalsContact CE2-O 3.27Å; Y268-C310 WeakPolarHBondContact CE2-O 3.49Å; Y268-C310 PolarHBondContact OH-O 3.38Å; C310-H312 PolarHBondContact O-N 3.24Å; C310-D313 HydrophobicContact CB-CB 4.42Å; C310-D313 WeakPolarHBondContact CB-O 3.46Å; C310-I316 HydrophobicContact CB-CB 3.6Å; C310-I316 HydrophobicContact CB-CG2 3.84Å; C310-I316 WeakPolarHBondContact CB-O 3.18Å; C310-I316 PolarHBondContact N-O 3.19Å
311	P	89	Confident	93.3	Very high	90 Å²	90	47.8 Å²	47.8	58%	0.584	26%	0.255	S	S	*	.	S	Bend	trans	-72.7	-5.7	-178.9	29.4	-35.9	0	0	0	113.9	Y268 W309	Y268-P311 PolarHBondContact OH-O 3.06Å; Y268-P311 VanDerWaalsContact OH-O 3.05Å; W309-P311 WeakPolarHBondContact O-CD 3.24Å
312	H	88.3	Confident	93.2	Very high	119 Å²	119	47.8 Å²	47.8	55%	0.551	26%	0.264	S	S	*	.	S	Bend	trans	-121.1	-10.7	180	-54.1	-39.7	0	0	0	115.1	Q7 Y268 C310	Q7-H312 PolarHBondContact NE2-CE1 2.83Å; Q7-H312 PolarHBondContact NE2-NE2 3.28Å; Q7-H312 PolarHBondContact OE1-CE1 3.17Å; Y268-H312 VanDerWaalsContact OH-CA 3.31Å; Y268-H312 WeakPolarHBondContact OH-CA 3.43Å; Y268-H312 PolarHBondContact OH-N 3.29Å; C310-H312 PolarHBondContact O-N 3.24Å
313	D	92	Very high	92.8	Very high	55 Å²	55	51 Å²	51	29%	0.294	29%	0.285	S	S	.	.			trans	-138.4	118.7	177.4	-168	-20.5	0	0	0	110.6	Y268 C310 R315 I316	Y268-D313 PolarHBondContact OH-N 3.3Å; C310-D313 HydrophobicContact CB-CB 4.42Å; C310-D313 WeakPolarHBondContact CB-O 3.46Å; D313-R315 PolarHBondContact O-N 2.7Å; D313-R315 VanDerWaalsContact OD1-CB 3.31Å; D313-R315 WeakPolarHBondContact OD1-CB 3.35Å; D313-R315 WeakPolarHBondContact OD1-CG 3.43Å; D313-R315 PolarHBondContact OD1-N 2.69Å; D313-I316 HydrophobicContact CB-CB 4.31Å; D313-I316 HydrophobicContact CB-CD1 3.86Å; D313-I316 HydrophobicContact CB-CG1 3.98Å; D313-I316 PolarHBondContact O-N 2.84Å; D313-I316 WeakPolarHBondContact OD2-CD1 3.31Å
314	E	93	Very high	92.1	Very high	109 Å²	109	60.4 Å²	60.4	51%	0.509	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-19.4	179.4	69.9	-178.2	164.7	0	0	114.3	Y268	Y268-E314 HydrophobicContact CD1-CB 3.85Å; Y268-E314 HydrophobicContact CD2-CB 3.38Å; Y268-E314 HydrophobicContact CE1-CB 4.23Å; Y268-E314 HydrophobicContact CE2-CB 3.8Å; Y268-E314 HydrophobicContact CG-CB 3.39Å
315	R	92.8	Very high	91.8	Very high	98 Å²	98	65.6 Å²	65.6	37%	0.37	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88	-16.5	-174.9	-54.5	163.9	-168.9	-158	-5.5	111.9	D313 W329 N330 L331 E332	D313-R315 PolarHBondContact O-N 2.7Å; D313-R315 VanDerWaalsContact OD1-CB 3.31Å; D313-R315 WeakPolarHBondContact OD1-CB 3.35Å; D313-R315 WeakPolarHBondContact OD1-CG 3.43Å; D313-R315 PolarHBondContact OD1-N 2.69Å; R315-W329 VanDerWaalsContact O-O 3.1Å; R315-N330 CarbonylContact O-C 3.6Å; R315-N330 WeakPolarHBondContact O-CA 3.04Å; R315-L331 WeakPolarHBondContact O-CG 3.3Å; R315-L331 PolarHBondContact O-N 3.3Å; R315-E332 HydrophobicContact CG-CG 4.04Å; R315-E332 VanDerWaalsContact CZ-CD 3.44Å; R315-E332 IonicContact CZ-OE1 3.88Å; R315-E332 IonicContact CZ-OE2 3.45Å; R315-E332 IonicContact NE-OE1 3.22Å; R315-E332 PolarHBondContact NE-OE1 3.26Å; R315-E332 IonicContact NH1-OE1 3.63Å; R315-E332 PolarHBondContact NH1-OE1 2.93Å; R315-E332 IonicContact NH1-OE2 3.12Å; R315-E332 PolarHBondContact NH1-OE2 2.89Å; R315-E332 IonicContact NH2-OE1 2.65Å; R315-E332 PolarHBondContact NH2-OE1 2.69Å
316	I	95.2	Very high	91.7	Very high	53 Å²	53	69.9 Å²	69.9	27%	0.272	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	118.8	-171.1	-59.7	178.2	0	0	0	110.1	C310 D313 L328 W329	C310-I316 HydrophobicContact CB-CB 3.6Å; C310-I316 HydrophobicContact CB-CG2 3.84Å; C310-I316 WeakPolarHBondContact CB-O 3.18Å; C310-I316 PolarHBondContact N-O 3.19Å; D313-I316 HydrophobicContact CB-CB 4.31Å; D313-I316 HydrophobicContact CB-CD1 3.86Å; D313-I316 HydrophobicContact CB-CG1 3.98Å; D313-I316 PolarHBondContact O-N 2.84Å; D313-I316 WeakPolarHBondContact OD2-CD1 3.31Å; I316-L328 HydrophobicContact CG2-CD2 4.29Å; I316-W329 WeakPolarHBondContact CA-O 3.47Å
317	L	95.4	Very high	91.6	Very high	0 Å²	0	69.1 Å²	69.1	0%	0	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	135	169.6	-169.5	74.5	0	0	0	109.2	A274 T282 L284 M297 I307 W309 L328 W329	A274-L317 HydrophobicContact CB-CD1 4.35Å; A274-L317 HydrophobicContact CB-CD2 4.19Å; T282-L317 HydrophobicContact CG2-CD2 3.69Å; L284-L317 HydrophobicContact CD2-CD2 4.47Å; M297-L317 HydrophobicContact CE-CD2 3.82Å; I307-L317 HydrophobicContact CG2-CD1 3.51Å; I307-L317 HydrophobicContact CG2-CD2 4.13Å; I307-L317 HydrophobicContact CG2-CG 3.93Å; W309-L317 HydrophobicContact CD2-CD1 3.49Å; W309-L317 VanDerWaalsContact CD2-CD1 3.49Å; W309-L317 HydrophobicContact CE3-CD1 3.97Å; W309-L317 HydrophobicContact CG-CD1 3.76Å; W309-L317 HydrophobicContact CH2-CD1 4.44Å; W309-L317 HydrophobicContact CZ2-CD1 4.03Å; W309-L317 HydrophobicContact CZ3-CD1 4.42Å; L317-L328 CarbonylContact O-C 3.52Å; L317-L328 WeakPolarHBondContact O-CA 3.02Å; L317-W329 HydrophobicContact CB-CB 4.2Å; L317-W329 PolarHBondContact N-O 2.99Å; L317-W329 VanDerWaalsContact N-O 3.11Å; L317-W329 PolarHBondContact O-N 2.96Å
318	A	95.5	Very high	91.5	Very high	27 Å²	27	74.8 Å²	74.8	22%	0.223	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	131.7	173.4	0	0	0	0	0	110.3	I307 D308 Q327 L328	I307-A318 WeakPolarHBondContact CA-O 3.28Å; D308-A318 PolarHBondContact N-O 3.25Å; D308-A318 PolarHBondContact O-N 3.16Å; A318-Q327 CarbonylContact C-O 3.5Å; A318-Q327 WeakPolarHBondContact CA-O 3.43Å; A318-L328 HydrophobicContact CB-CD2 3.7Å
319	T	95.2	Very high	91.4	Very high	0 Å²	0	71.5 Å²	71.5	0%	0	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	137.6	171.1	57.4	0	0	0	0	109.6	T282 N299 I304 K306 I307 I326 Q327 W329	T282-T319 HydrophobicContact CG2-CG2 4.07Å; T282-T319 WeakPolarHBondContact OG1-CG2 3.24Å; N299-T319 PolarHBondContact ND2-OG1 2.94Å; I304-T319 HydrophobicContact CG2-CG2 4.37Å; K306-T319 WeakPolarHBondContact O-CA 3.34Å; I307-T319 HydrophobicContact CG1-CG2 3.92Å; T319-I326 CarbonylContact O-C 3.57Å; T319-I326 WeakPolarHBondContact O-CA 3.48Å; T319-Q327 PolarHBondContact N-O 2.96Å; T319-Q327 PolarHBondContact O-N 2.8Å; T319-Q327 PolarHBondContact OG1-O 3.31Å; T319-W329 VanDerWaalsContact CG2-NE1 3.27Å; T319-W329 PolarHBondContact OG1-NE1 2.82Å
320	S	93.4	Very high	91.2	Very high	35 Å²	35	75.6 Å²	75.6	25%	0.245	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	150	173.8	61.2	0	0	0	0	111.3	A305 K306	A305-S320 PolarHBondContact N-O 2.69Å; K306-S320 WeakPolarHBondContact CB-OG 3.43Å; K306-S320 PolarHBondContact N-OG 2.82Å; K306-S320 PolarHBondContact O-N 3.43Å; K306-S320 PolarHBondContact O-OG 3.44Å
321	N	90.4	Very high	91.1	Very high	9 Å²	9	76.5 Å²	76.5	5%	0.048	39%	0.386	C	S	.	.			trans	-120.7	146.2	179	179.2	-67	0	0	0	110.2	E301 G302 P303 S323 R324 F325	E301-N321 PolarHBondContact O-ND2 3.24Å; G302-N321 WeakPolarHBondContact CA-ND2 3.31Å; G302-N321 PolarHBondContact N-ND2 3.12Å; G302-N321 PolarHBondContact O-ND2 2.83Å; G302-N321 VanDerWaalsContact O-ND2 3.09Å; P303-N321 WeakPolarHBondContact O-CA 3.5Å; P303-N321 PolarHBondContact O-ND2 3.11Å; N321-S323 PolarHBondContact O-N 2.97Å; N321-S323 VanDerWaalsContact O-N 3.14Å; N321-S323 VanDerWaalsContact OD1-CA 3.3Å; N321-S323 WeakPolarHBondContact OD1-CA 3.34Å; N321-S323 WeakPolarHBondContact OD1-CB 3.37Å; N321-S323 PolarHBondContact OD1-N 3.14Å; N321-S323 PolarHBondContact OD1-OG 3.49Å; N321-R324 PolarHBondContact O-N 3.47Å; N321-F325 PolarHBondContact N-O 3.48Å
322	P	86.4	Confident	90.7	Very high	94 Å²	94	80.6 Å²	80.6	61%	0.61	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.5	-27.3	176.2	-24.5	34.5	0	0	0	114.4	P303 A305 R324	P303-P322 WeakPolarHBondContact O-CD 3.29Å; A305-P322 HydrophobicContact CB-CG 4.1Å; P322-R324 PolarHBondContact O-N 2.89Å
323	S	83.2	Confident	90.8	Very high	73 Å²	73	78.7 Å²	78.7	51%	0.51	39%	0.39	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.3	18.4	179.8	-46.5	0	0	0	0	114.3	N321	N321-S323 PolarHBondContact O-N 2.97Å; N321-S323 VanDerWaalsContact O-N 3.14Å; N321-S323 VanDerWaalsContact OD1-CA 3.3Å; N321-S323 WeakPolarHBondContact OD1-CA 3.34Å; N321-S323 WeakPolarHBondContact OD1-CB 3.37Å; N321-S323 PolarHBondContact OD1-N 3.14Å; N321-S323 PolarHBondContact OD1-OG 3.49Å
324	R	81.7	Confident	90.7	Very high	237 Å²	237	79.9 Å²	79.9	89%	0.894	40%	0.395	S	S	*	.	S	Bend	trans	83.1	8.1	168	-46.7	169.9	-178.3	-173.9	-1.1	116.8	N321 P322	N321-R324 PolarHBondContact O-N 3.47Å; P322-R324 PolarHBondContact O-N 2.89Å
325	F	87.5	Confident	90.6	Very high	108 Å²	108	78.3 Å²	78.3	47%	0.474	39%	0.388	S	S	.	.			trans	-94	140.3	174.7	-64.9	-78.3	0	0	0	111.7	E301 N321	E301-F325 HydrophobicContact CB-CB 4.21Å; E301-F325 HydrophobicContact CB-CD2 3.91Å; E301-F325 HydrophobicContact CB-CG 4.22Å; E301-F325 HydrophobicContact CG-CB 4.21Å; E301-F325 HydrophobicContact CG-CD2 4.03Å; E301-F325 HydrophobicContact CG-CG 4.03Å; E301-F325 WeakPolarHBondContact OE2-CE2 3.32Å; N321-F325 PolarHBondContact N-O 3.48Å
326	I	91.5	Very high	90.5	Very high	130 Å²	130	77.1 Å²	77.1	67%	0.667	39%	0.39	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114.7	126.5	164.1	-60.4	173.9	0	0	0	106.2	T319	T319-I326 CarbonylContact O-C 3.57Å; T319-I326 WeakPolarHBondContact O-CA 3.48Å
327	Q	91.7	Very high	90.2	Very high	53 Å²	53	78.6 Å²	78.6	25%	0.248	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	134.1	177.9	-175.4	167.2	10.7	0	0	109.4	N299 A318 T319 W329	N299-Q327 PolarHBondContact ND2-OE1 3.5Å; N299-Q327 PolarHBondContact OD1-OE1 2.81Å; A318-Q327 CarbonylContact C-O 3.5Å; A318-Q327 WeakPolarHBondContact CA-O 3.43Å; T319-Q327 PolarHBondContact N-O 2.96Å; T319-Q327 PolarHBondContact O-N 2.8Å; T319-Q327 PolarHBondContact OG1-O 3.31Å; Q327-W329 HydrophobicContact CG-CD2 4.4Å; Q327-W329 HydrophobicContact CG-CH2 4.48Å; Q327-W329 HydrophobicContact CG-CZ2 3.89Å; Q327-W329 VanDerWaalsContact NE2-CH2 3.27Å
328	L	93.7	Very high	89.8	Confident	123 Å²	123	83.9 Å²	83.9	64%	0.644	42%	0.423	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103.4	129.8	173.5	-61.6	177.3	0	0	0	108.4	I316 L317 A318	I316-L328 HydrophobicContact CG2-CD2 4.29Å; L317-L328 CarbonylContact O-C 3.52Å; L317-L328 WeakPolarHBondContact O-CA 3.02Å; A318-L328 HydrophobicContact CB-CD2 3.7Å
329	W	93.2	Very high	89.4	Confident	39 Å²	39	87.9 Å²	87.9	15%	0.148	44%	0.438	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	137.3	178.1	-54	88.2	0	0	0	108.9	M297 E298 N299 R315 I316 L317 T319 Q327 L331	M297-W329 HydrophobicContact CB-CD2 4.35Å; M297-W329 HydrophobicContact CB-CE3 3.95Å; M297-W329 HydrophobicContact CB-CH2 3.94Å; M297-W329 HydrophobicContact CB-CZ2 4.33Å; M297-W329 HydrophobicContact CB-CZ3 3.74Å; M297-W329 HydrophobicContact CE-CG 4.43Å; M297-W329 HydrophobicContact CG-CE3 4.14Å; M297-W329 HydrophobicContact CG-CZ3 4.31Å; M297-W329 HydrophobicContact SD-CB 4.12Å; M297-W329 HydrophobicContact SD-CD2 3.88Å; M297-W329 HydrophobicContact SD-CE3 3.73Å; M297-W329 HydrophobicContact SD-CG 4.05Å; M297-W329 HydrophobicContact SD-CZ3 4.46Å; E298-W329 WeakPolarHBondContact O-CH2 3.32Å; N299-W329 HydrophobicContact CB-CZ2 4.16Å; R315-W329 VanDerWaalsContact O-O 3.1Å; I316-W329 WeakPolarHBondContact CA-O 3.47Å; L317-W329 HydrophobicContact CB-CB 4.2Å; L317-W329 PolarHBondContact N-O 2.99Å; L317-W329 VanDerWaalsContact N-O 3.11Å; L317-W329 PolarHBondContact O-N 2.96Å; T319-W329 VanDerWaalsContact CG2-NE1 3.27Å; T319-W329 PolarHBondContact OG1-NE1 2.82Å; Q327-W329 HydrophobicContact CG-CD2 4.4Å; Q327-W329 HydrophobicContact CG-CH2 4.48Å; Q327-W329 HydrophobicContact CG-CZ2 3.89Å; Q327-W329 VanDerWaalsContact NE2-CH2 3.27Å; W329-L331 HydrophobicContact CB-CD2 4.39Å
330	N	93.2	Very high	89	Confident	101 Å²	101	94.7 Å²	94.7	54%	0.54	47%	0.471	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	123.3	163.8	-175.9	-1.4	0	0	0	107.8	R315 E332	R315-N330 CarbonylContact O-C 3.6Å; R315-N330 WeakPolarHBondContact O-CA 3.04Å; N330-E332 PolarHBondContact OD1-N 3.15Å
331	L	89.9	Confident	88.6	Confident	53 Å²	53	99.7 Å²	99.7	28%	0.277	49%	0.49	S	S	.	.			trans	-90.2	1.9	-174.6	-59.5	-178.5	0	0	0	114.5	L284 M297 W309 R315 W329	L284-L331 HydrophobicContact CD1-CD1 4.11Å; L284-L331 HydrophobicContact CD1-CD2 3.89Å; M297-L331 HydrophobicContact CE-CD2 3.99Å; M297-L331 HydrophobicContact SD-CD2 3.7Å; W309-L331 HydrophobicContact CH2-CD1 3.71Å; W309-L331 HydrophobicContact CZ3-CD1 3.47Å; W309-L331 VanDerWaalsContact CZ3-CD1 3.47Å; R315-L331 WeakPolarHBondContact O-CG 3.3Å; R315-L331 PolarHBondContact O-N 3.3Å; W329-L331 HydrophobicContact CB-CD2 4.39Å
332	E	81.2	Confident	88.5	Confident	176 Å²	176	107.9 Å²	107.9	82%	0.822	53%	0.53	S	S	*	.			trans	-74.6	0	168.8	-74.1	-171.3	139.7	0	0	113.3	R315 N330	R315-E332 HydrophobicContact CG-CG 4.04Å; R315-E332 VanDerWaalsContact CZ-CD 3.44Å; R315-E332 IonicContact CZ-OE1 3.88Å; R315-E332 IonicContact CZ-OE2 3.45Å; R315-E332 IonicContact NE-OE1 3.22Å; R315-E332 PolarHBondContact NE-OE1 3.26Å; R315-E332 IonicContact NH1-OE1 3.63Å; R315-E332 PolarHBondContact NH1-OE1 2.93Å; R315-E332 IonicContact NH1-OE2 3.12Å; R315-E332 PolarHBondContact NH1-OE2 2.89Å; R315-E332 IonicContact NH2-OE1 2.65Å; R315-E332 PolarHBondContact NH2-OE1 2.69Å; N330-E332 PolarHBondContact OD1-N 3.15Å

Retrieved 332 of 332 residues in 192.5 ms (Link to these results)

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