A0A077YXA4_TRITR Loading...

EGF CA and EGF domain containing protein

AlphaFold DB , UniProt , Accession A0A077YXA4, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 608 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	27	Very low	27.3	Very low	171 Å²	171	133.4 Å²	133.4	84%	0.842	75%	0.754	S	S	*	*				0	142.3	0	-65.6	-178.4	179	0	0	110.1	Y117	M1-Y117 HydrophobicContact CE-CE1 4.17Å; M1-Y117 VanDerWaalsContact CE-OH 3.29Å; M1-Y117 WeakPolarHBondContact CE-OH 3.38Å
2	V	25.5	Very low	27.7	Very low	129 Å²	129	135.6 Å²	135.6	78%	0.782	75%	0.749	S	S	*	*			trans	-86	129.3	157.8	177.1	0	0	0	0	107.2	I4	V2-I4 PolarHBondContact O-N 3.25Å
3	P	24.8	Very low	27.6	Very low	116 Å²	116	133.4 Å²	133.4	75%	0.753	75%	0.749	S	S	*	*			trans	-65.6	121.8	173.4	27.2	-32.9	0	0	0	109.3	D5	P3-D5 PolarHBondContact O-N 2.9Å; P3-D5 VanDerWaalsContact O-N 3.15Å
4	I	27.8	Very low	27.6	Very low	155 Å²	155	135.1 Å²	135.1	80%	0.795	75%	0.753	S	S	*	*			trans	-74.6	107.4	169.7	-63.2	-179.3	0	0	0	106.9	V2 C6	V2-I4 PolarHBondContact O-N 3.25Å; I4-C6 PolarHBondContact O-N 3.42Å
5	D	25.7	Very low	27.4	Very low	139 Å²	139	134.1 Å²	134.1	74%	0.743	75%	0.751	S	S	*	*			trans	-42.8	122.6	-172.3	179	28.7	0	0	0	114.2	P3 G7	P3-D5 PolarHBondContact O-N 2.9Å; P3-D5 VanDerWaalsContact O-N 3.15Å; D5-G7 PolarHBondContact O-N 3.04Å; D5-G7 PolarHBondContact OD1-N 3.28Å
6	C	27.1	Very low	27.4	Very low	132 Å²	132	140.6 Å²	140.6	89%	0.892	76%	0.761	S	S	*	*			trans	-82	52.5	170.3	-72.8	0	0	0	0	110.5	I4	I4-C6 PolarHBondContact O-N 3.42Å
7	G	27	Very low	27.2	Very low	35 Å²	35	142.2 Å²	142.2	36%	0.361	75%	0.753	S	S	.	*	P	Polyproline II helix	trans	-60.9	152.5	-175	0	0	0	0	0	113.4	D5	D5-G7 PolarHBondContact O-N 3.04Å; D5-G7 PolarHBondContact OD1-N 3.28Å
8	P	29.4	Very low	27.2	Very low	131 Å²	131	144.6 Å²	144.6	85%	0.851	76%	0.762	S	S	*	*	P	Polyproline II helix	trans	-63.7	150.2	-169.6	-22.8	34.1	0	0	0	114.6	D10	P8-D10 PolarHBondContact O-N 3.43Å
9	F	28.5	Very low	27.2	Very low	187 Å²	187	143.8 Å²	143.8	82%	0.82	76%	0.757	S	S	*	*	P	Polyproline II helix	trans	-67.1	122.7	169.5	-76.9	-99.3	0	0	0	110.7
10	D	27.3	Very low	27.3	Very low	108 Å²	108	145.6 Å²	145.6	58%	0.578	76%	0.761	S	S	*	*	P	Polyproline II helix	trans	-65.2	137.6	174.8	-175.1	18.4	0	0	0	111.3	P8 K12	P8-D10 PolarHBondContact O-N 3.43Å; D10-K12 PolarHBondContact O-N 2.76Å; D10-K12 IonicContact OD2-NZ 3.69Å
11	N	29.9	Very low	27.3	Very low	164 Å²	164	145.6 Å²	145.6	88%	0.877	76%	0.76	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.6	28.4	-167.9	-80.5	-39.4	0	0	0	114.6
12	K	32.1	Very low	27.4	Very low	160 Å²	160	144.7 Å²	144.7	70%	0.696	76%	0.759	S	S	*	*	T	Hydrogen-bonded Turn	trans	-116.7	8.7	-171.9	-67.6	175.6	-171.7	147.4	0	114.8	D10 I14	D10-K12 PolarHBondContact O-N 2.76Å; D10-K12 IonicContact OD2-NZ 3.69Å; K12-I14 PolarHBondContact O-N 3.31Å
13	S	27.1	Very low	27.7	Very low	107 Å²	107	142.8 Å²	142.8	75%	0.748	75%	0.751	S	S	*	*			trans	-86.1	96.6	176.3	-62.1	0	0	0	0	111.1
14	I	27.5	Very low	27.9	Very low	157 Å²	157	145.9 Å²	145.9	81%	0.805	76%	0.756	S	S	*	*			trans	-69.4	128.5	-171.2	-62.4	170.4	0	0	0	112.5	K12	K12-I14 PolarHBondContact O-N 3.31Å
15	V	24.1	Very low	28	Very low	120 Å²	120	145.4 Å²	145.4	73%	0.727	75%	0.75	S	S	*	*			trans	-87.1	139.4	170.5	178.2	0	0	0	0	110.7
16	R	27.9	Very low	28.2	Very low	239 Å²	239	146.9 Å²	146.9	90%	0.902	75%	0.75	S	S	*	*			trans	-135.5	127.5	160.7	-82.3	-171.4	168.3	-175.6	-4.1	110.9
17	R	24.4	Very low	28.1	Very low	168 Å²	168	147.6 Å²	147.6	63%	0.634	74%	0.744	S	S	*	*			trans	-114.5	137.2	171.4	-75.3	-176.2	176.4	-178.2	0.9	110	E29	R17-E29 IonicContact CZ-OE1 2.77Å; R17-E29 IonicContact NE-OE1 3.61Å; R17-E29 IonicContact NH2-OE1 3.3Å; R17-E29 PolarHBondContact NH2-OE1 3.19Å
18	M	27	Very low	28	Very low	185 Å²	185	154 Å²	154	91%	0.911	76%	0.762	S	S	*	*			trans	-174.3	117.2	152.1	-101.7	161.7	170.1	0	0	103.8
19	I	25.8	Very low	27.8	Very low	129 Å²	129	154.7 Å²	154.7	66%	0.662	75%	0.754	S	S	*	*			cis	74.5	94.2	42.5	-51.5	171.4	0	0	0	112.1
20	E	29.2	Very low	27.7	Very low	179 Å²	179	152.9 Å²	152.9	84%	0.836	74%	0.743	S	S	*	*				-155.7	112	121.1	-101.8	165.2	177	0	0	105.9
21	I	28.7	Very low	27.7	Very low	146 Å²	146	151.9 Å²	151.9	75%	0.749	74%	0.737	S	S	*	*				63.4	98.1	94.7	-60.7	173.6	0	0	0	112.3
22	D	28.7	Very low	27.6	Very low	152 Å²	152	148.1 Å²	148.1	81%	0.813	72%	0.719	S	S	*	*				-139.3	177	109.3	-149.2	-20.4	0	0	0	109.4
23	S	31.9	Very low	27.3	Very low	89 Å²	89	145.1 Å²	145.1	62%	0.622	71%	0.71	S	S	*	*	S	Bend	trans	-66.1	139.4	-154.7	60.1	0	0	0	0	118
24	Q	28.2	Very low	27.3	Very low	181 Å²	181	143.4 Å²	143.4	85%	0.846	69%	0.693	S	S	*	*			trans	62.5	123.8	155.9	-62.4	175.6	15.9	0	0	117.6
25	E	29.6	Very low	27.4	Very low	146 Å²	146	138 Å²	138	68%	0.682	68%	0.676	S	S	*	*			cis	-145.2	157.7	2.5	-85.1	-144.2	94.9	0	0	112.8
26	K	30.1	Very low	27.6	Very low	169 Å²	169	136 Å²	136	74%	0.735	66%	0.664	S	S	*	*			trans	32.9	121	157.2	-57.5	-170.5	-174.5	81.9	0	120.3
27	L	25.2	Very low	27.8	Very low	147 Å²	147	133.4 Å²	133.4	77%	0.77	65%	0.654	S	S	*	*			trans	-67.9	152.4	173.8	-69.1	77	0	0	0	113.8
28	K	25.3	Very low	28.1	Very low	169 Å²	169	129.5 Å²	129.5	74%	0.735	65%	0.645	S	S	*	*			trans	-121.2	143.6	140.9	-79.5	-171.4	173.8	-176.4	0	109	Y30	K28-Y30 HydrophobicContact CB-CE1 4.21Å
29	E	25.8	Very low	28.5	Very low	147 Å²	147	123.8 Å²	123.8	69%	0.687	62%	0.62	S	S	*	*			trans	-80.7	151	175.5	-66.6	-162.5	134.5	0	0	111.7	R17	R17-E29 IonicContact CZ-OE1 2.77Å; R17-E29 IonicContact NE-OE1 3.61Å; R17-E29 IonicContact NH2-OE1 3.3Å; R17-E29 PolarHBondContact NH2-OE1 3.19Å
30	Y	26.7	Very low	28.8	Very low	149 Å²	149	124.4 Å²	124.4	58%	0.584	62%	0.618	S	S	*	*			trans	-148.4	113.7	-151.7	-86.8	-16.8	0	0	0	110.2	K28 P125	K28-Y30 HydrophobicContact CB-CE1 4.21Å; Y30-P125 HydrophobicContact CD1-CG 3.99Å; Y30-P125 HydrophobicContact CD2-CG 4.39Å; Y30-P125 HydrophobicContact CE1-CG 4.19Å; Y30-P125 VanDerWaalsContact CG-CD 3.44Å; Y30-P125 HydrophobicContact CG-CG 4.08Å
31	I	27	Very low	28.9	Very low	87 Å²	87	125.4 Å²	125.4	45%	0.446	61%	0.614	S	S	.	*			trans	-96.8	111.6	-176.5	-58.6	179.8	0	0	0	108.8	L33 R123 T124	I31-L33 PolarHBondContact O-N 3.14Å; I31-R123 HydrophobicContact CD1-CB 4.4Å; I31-R123 HydrophobicContact CD1-CG 4.23Å; I31-T124 PolarHBondContact N-O 3.03Å; I31-T124 CarbonylContact O-C 3.43Å; I31-T124 WeakPolarHBondContact O-CA 3.37Å
32	V	26.7	Very low	29.2	Very low	84 Å²	84	120.6 Å²	120.6	51%	0.509	59%	0.592	S	S	.	*			trans	-70.7	94.9	176.1	-170.2	0	0	0	0	110.4	D34	V32-D34 PolarHBondContact O-N 3.07Å
33	L	26.9	Very low	29.4	Very low	98 Å²	98	116.3 Å²	116.3	51%	0.513	57%	0.569	S	S	.	*			trans	-74.5	113.1	155.8	-65.6	-171.8	0	0	0	108.3	I31 G35 T124	I31-L33 PolarHBondContact O-N 3.14Å; L33-G35 PolarHBondContact O-N 3.1Å; L33-T124 HydrophobicContact CB-CG2 3.86Å; L33-T124 HydrophobicContact CD1-CG2 3.99Å; L33-T124 HydrophobicContact CG-CG2 4.06Å
34	D	27.7	Very low	29.6	Very low	71 Å²	71	122.5 Å²	122.5	38%	0.38	58%	0.579	S	S	.	*			trans	-75.8	111.9	176.8	174.1	5.3	0	0	0	109.8	V32 T36 R37 I38	V32-D34 PolarHBondContact O-N 3.07Å; D34-T36 PolarHBondContact O-N 3.39Å; D34-T36 WeakPolarHBondContact OD1-CA 3.4Å; D34-T36 VanDerWaalsContact OD1-CB 3.3Å; D34-T36 WeakPolarHBondContact OD1-CB 3.29Å; D34-T36 WeakPolarHBondContact OD1-CG2 3.44Å; D34-T36 PolarHBondContact OD1-N 2.98Å; D34-T36 PolarHBondContact OD1-OG1 3.32Å; D34-T36 PolarHBondContact OD2-OG1 3.45Å; D34-R37 HydrophobicContact CB-CB 4.3Å; D34-R37 HydrophobicContact CB-CG 4.34Å; D34-R37 WeakPolarHBondContact O-CA 3.34Å; D34-R37 WeakPolarHBondContact O-CB 3.49Å; D34-R37 PolarHBondContact O-N 2.94Å; D34-I38 PolarHBondContact O-N 2.88Å
35	G	28.7	Very low	30.1	Very low	43 Å²	43	118.4 Å²	118.4	44%	0.443	57%	0.565	S	S	.	*	H	α-helix	trans	-57.8	-28.6	177	0	0	0	0	0	113.1	L33 R37 I38 V39	L33-G35 PolarHBondContact O-N 3.1Å; G35-R37 PolarHBondContact O-N 2.96Å; G35-I38 WeakPolarHBondContact O-CB 3.37Å; G35-I38 PolarHBondContact O-N 3.4Å; G35-I38 VanDerWaalsContact O-N 3.11Å; G35-V39 PolarHBondContact O-N 3.43Å; G35-V39 VanDerWaalsContact O-N 3.1Å
36	T	28.7	Very low	30.6	Very low	79 Å²	79	113.6 Å²	113.6	49%	0.485	54%	0.544	S	S	.	.	H	α-helix	trans	-70	-22	174.6	81.2	0	0	0	0	112.3	D34 K40	D34-T36 PolarHBondContact O-N 3.39Å; D34-T36 WeakPolarHBondContact OD1-CA 3.4Å; D34-T36 VanDerWaalsContact OD1-CB 3.3Å; D34-T36 WeakPolarHBondContact OD1-CB 3.29Å; D34-T36 WeakPolarHBondContact OD1-CG2 3.44Å; D34-T36 PolarHBondContact OD1-N 2.98Å; D34-T36 PolarHBondContact OD1-OG1 3.32Å; D34-T36 PolarHBondContact OD2-OG1 3.45Å; T36-K40 WeakPolarHBondContact O-CB 3.44Å; T36-K40 VanDerWaalsContact O-CG 3.26Å; T36-K40 WeakPolarHBondContact O-CG 3.39Å; T36-K40 PolarHBondContact O-N 3.17Å
37	R	30.8	Very low	30.8	Very low	183 Å²	183	115.2 Å²	115.2	69%	0.691	55%	0.551	S	S	*	*	H	α-helix	trans	-76.2	-28.2	169	-84.9	-175.8	167.2	-166.5	-2.4	113.2	D34 G35 R41	D34-R37 HydrophobicContact CB-CB 4.3Å; D34-R37 HydrophobicContact CB-CG 4.34Å; D34-R37 WeakPolarHBondContact O-CA 3.34Å; D34-R37 WeakPolarHBondContact O-CB 3.49Å; D34-R37 PolarHBondContact O-N 2.94Å; G35-R37 PolarHBondContact O-N 2.96Å; R37-R41 WeakPolarHBondContact O-CB 3.35Å; R37-R41 WeakPolarHBondContact O-CG 3.33Å; R37-R41 PolarHBondContact O-N 2.95Å
38	I	32.1	Very low	31.5	Very low	86 Å²	86	109.2 Å²	109.2	44%	0.441	53%	0.525	S	S	.	.	H	α-helix	trans	-66.8	-53.3	171.5	-58.5	177.9	0	0	0	108.3	D34 G35 K40 R41 T42 I106	D34-I38 PolarHBondContact O-N 2.88Å; G35-I38 WeakPolarHBondContact O-CB 3.37Å; G35-I38 PolarHBondContact O-N 3.4Å; G35-I38 VanDerWaalsContact O-N 3.11Å; I38-K40 VanDerWaalsContact C-N 3.34Å; I38-K40 PolarHBondContact O-N 2.89Å; I38-R41 PolarHBondContact O-N 3.01Å; I38-T42 PolarHBondContact O-N 3.4Å; I38-T42 PolarHBondContact O-OG1 3.37Å; I38-I106 HydrophobicContact CG2-CD1 4.41Å
39	V	34.2	Very low	32.4	Very low	66 Å²	66	106.3 Å²	106.3	40%	0.4	52%	0.522	S	S	.	.	H	α-helix	trans	-63.6	-34.6	177.5	-179.5	0	0	0	0	112.5	G35 R41 T42 N43	G35-V39 PolarHBondContact O-N 3.43Å; G35-V39 VanDerWaalsContact O-N 3.1Å; V39-R41 VanDerWaalsContact C-N 3.35Å; V39-T42 PolarHBondContact O-OG1 2.93Å; V39-T42 VanDerWaalsContact O-OG1 3.05Å; V39-N43 WeakPolarHBondContact CG1-ND2 3.36Å; V39-N43 WeakPolarHBondContact O-CB 3.35Å; V39-N43 PolarHBondContact O-N 3.37Å; V39-N43 PolarHBondContact O-ND2 3.46Å
40	K	32.2	Very low	33.4	Very low	142 Å²	142	104.3 Å²	104.3	62%	0.617	52%	0.515	S	S	*	.	H	α-helix	trans	-74.7	-17.9	171.8	-79.5	177.1	174.1	171.5	0	114.2	T36 I38 R44	T36-K40 WeakPolarHBondContact O-CB 3.44Å; T36-K40 VanDerWaalsContact O-CG 3.26Å; T36-K40 WeakPolarHBondContact O-CG 3.39Å; T36-K40 PolarHBondContact O-N 3.17Å; I38-K40 VanDerWaalsContact C-N 3.34Å; I38-K40 PolarHBondContact O-N 2.89Å; K40-R44 WeakPolarHBondContact O-CB 3.27Å; K40-R44 WeakPolarHBondContact O-CG 3.44Å; K40-R44 PolarHBondContact O-N 3.49Å
41	R	31.3	Very low	34.4	Very low	200 Å²	200	101.8 Å²	101.8	76%	0.755	51%	0.511	S	S	*	.	H	α-helix	trans	-82.3	-41.9	171.1	-85.7	-176.2	166.3	-169	-5.6	111	R37 I38 V39 R44 V45	R37-R41 WeakPolarHBondContact O-CB 3.35Å; R37-R41 WeakPolarHBondContact O-CG 3.33Å; R37-R41 PolarHBondContact O-N 2.95Å; I38-R41 PolarHBondContact O-N 3.01Å; V39-R41 VanDerWaalsContact C-N 3.35Å; R41-R44 PolarHBondContact O-N 3.43Å; R41-V45 WeakPolarHBondContact O-CG2 3.35Å; R41-V45 PolarHBondContact O-N 3.1Å
42	T	35.1	Very low	35.3	Very low	44 Å²	44	101.7 Å²	101.7	27%	0.27	51%	0.506	S	S	.	.	H	α-helix	trans	-62.1	-46.2	171.9	51.9	0	0	0	0	111.7	I38 V39 R44 V45 I46	I38-T42 PolarHBondContact O-N 3.4Å; I38-T42 PolarHBondContact O-OG1 3.37Å; V39-T42 PolarHBondContact O-OG1 2.93Å; V39-T42 VanDerWaalsContact O-OG1 3.05Å; T42-R44 PolarHBondContact O-N 3.42Å; T42-V45 PolarHBondContact O-N 3.24Å; T42-I46 PolarHBondContact O-N 2.88Å
43	N	33.1	Very low	36.2	Very low	63 Å²	63	105 Å²	105	34%	0.337	52%	0.515	S	S	.	.	H	α-helix	trans	-60.9	-13.1	171.9	-82.4	-77.2	0	0	0	114.8	V39	V39-N43 WeakPolarHBondContact CG1-ND2 3.36Å; V39-N43 WeakPolarHBondContact O-CB 3.35Å; V39-N43 PolarHBondContact O-N 3.37Å; V39-N43 PolarHBondContact O-ND2 3.46Å
44	R	35.9	Very low	36.9	Very low	219 Å²	219	102.3 Å²	102.3	83%	0.826	50%	0.503	S	S	*	.	H	α-helix	trans	-95.9	-17.2	173.2	-86.5	-176.6	171	-160	-2.6	113.9	K40 R41 T42	K40-R44 WeakPolarHBondContact O-CB 3.27Å; K40-R44 WeakPolarHBondContact O-CG 3.44Å; K40-R44 PolarHBondContact O-N 3.49Å; R41-R44 PolarHBondContact O-N 3.43Å; T42-R44 PolarHBondContact O-N 3.42Å
45	V	39.4	Very low	37.5	Very low	94 Å²	94	102.3 Å²	102.3	57%	0.57	51%	0.505	S	S	*	.	H	α-helix	trans	-101.4	-29.8	-178.6	174	0	0	0	0	111.4	R41 T42 K47	R41-V45 WeakPolarHBondContact O-CG2 3.35Å; R41-V45 PolarHBondContact O-N 3.1Å; T42-V45 PolarHBondContact O-N 3.24Å; V45-K47 PolarHBondContact O-N 3.08Å
46	I	39.2	Very low	38.2	Very low	46 Å²	46	102.3 Å²	102.3	24%	0.236	50%	0.495	C	S	.	.			trans	-103.1	75.8	179.8	-46.3	177.2	0	0	0	109.7	T42 V72	T42-I46 PolarHBondContact O-N 2.88Å; I46-V72 HydrophobicContact CD1-CG2 4.4Å; I46-V72 HydrophobicContact CG2-CG1 3.96Å
47	K	35	Very low	38.7	Very low	202 Å²	202	102.5 Å²	102.5	88%	0.878	49%	0.493	S	S	*	.			trans	-98	101.3	156.4	-86.8	-165	171.4	-166.4	0	108.2	V45	V45-K47 PolarHBondContact O-N 3.08Å
48	G	40.3	Very low	39.2	Very low	22 Å²	22	95.3 Å²	95.3	23%	0.227	47%	0.468	C	S	.	.			trans	-123	163.4	166.2	0	0	0	0	0	110.8	I50	G48-I50 VanDerWaalsContact C-N 3.35Å
49	T	44.3	Very low	39.5	Very low	108 Å²	108	94.4 Å²	94.4	66%	0.663	47%	0.469	S	S	*	.	S	Bend	trans	-90.7	1	-176.4	46.8	0	0	0	0	113.6	F75	T49-F75 HydrophobicContact CG2-CZ 4.26Å
50	I	46.5	Very low	39.7	Very low	105 Å²	105	94.4 Å²	94.4	54%	0.538	47%	0.466	S	S	.	.	S	Bend	trans	-126.2	162.6	-172.1	-36.2	174.8	0	0	0	107.8	G48 Y52	G48-I50 VanDerWaalsContact C-N 3.35Å; I50-Y52 HydrophobicContact CB-CE1 4.02Å; I50-Y52 HydrophobicContact CB-CE2 4.21Å; I50-Y52 HydrophobicContact CD1-CE1 4.3Å; I50-Y52 HydrophobicContact CG1-CE1 4.44Å; I50-Y52 WeakPolarHBondContact CG1-OH 3.47Å; I50-Y52 VanDerWaalsContact O-CD2 3.26Å; I50-Y52 WeakPolarHBondContact O-CD2 3.44Å; I50-Y52 WeakPolarHBondContact O-CE2 3.25Å
51	N	46.9	Very low	39.8	Very low	95 Å²	95	89.1 Å²	89.1	51%	0.508	45%	0.452	S	S	.	.			trans	-75.4	141.3	164.3	-61.8	-22.4	0	0	0	109.1	V72 K73 A74	N51-V72 CarbonylContact C-O 3.4Å; N51-V72 VanDerWaalsContact CA-O 3.31Å; N51-V72 WeakPolarHBondContact CA-O 3.43Å; N51-K73 WeakPolarHBondContact OD1-CA 3.29Å; N51-A74 PolarHBondContact OD1-N 3.45Å
52	Y	47.2	Very low	39.8	Very low	86 Å²	86	87.3 Å²	87.3	34%	0.337	46%	0.457	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	132	175	-48.1	-88	0	0	0	110.3	I50 V72	I50-Y52 HydrophobicContact CB-CE1 4.02Å; I50-Y52 HydrophobicContact CB-CE2 4.21Å; I50-Y52 HydrophobicContact CD1-CE1 4.3Å; I50-Y52 HydrophobicContact CG1-CE1 4.44Å; I50-Y52 WeakPolarHBondContact CG1-OH 3.47Å; I50-Y52 VanDerWaalsContact O-CD2 3.26Å; I50-Y52 WeakPolarHBondContact O-CD2 3.44Å; I50-Y52 WeakPolarHBondContact O-CE2 3.25Å; Y52-V72 PolarHBondContact N-O 2.85Å; Y52-V72 PolarHBondContact O-N 3.13Å
53	H	44	Very low	39.8	Very low	153 Å²	153	88.2 Å²	88.2	71%	0.708	47%	0.47	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.6	138	166.4	-75.6	-129.6	0	0	0	108.7	T71	H53-T71 PolarHBondContact NE2-OG1 2.94Å
54	V	42.8	Very low	39.8	Very low	41 Å²	41	90 Å²	90	25%	0.248	48%	0.478	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	113.7	179.4	-175	0	0	0	0	109.2	Y70 V72	V54-Y70 HydrophobicContact CB-CD2 4.07Å; V54-Y70 HydrophobicContact CB-CE1 4.15Å; V54-Y70 HydrophobicContact CB-CE2 3.65Å; V54-Y70 HydrophobicContact CG1-CE1 4.01Å; V54-Y70 HydrophobicContact CG1-CE2 4.07Å; V54-Y70 WeakPolarHBondContact CG1-OH 3.36Å; V54-Y70 HydrophobicContact CG2-CE2 4.07Å; V54-Y70 PolarHBondContact N-O 2.87Å; V54-Y70 WeakPolarHBondContact O-CD1 3.12Å; V54-Y70 PolarHBondContact O-N 3.47Å; V54-V72 HydrophobicContact CG2-CG2 3.91Å
55	T	40.4	Very low	40	Very low	71 Å²	71	85.7 Å²	85.7	44%	0.436	46%	0.463	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	119.2	170.6	-57.6	0	0	0	0	109.6	L57 N67 N69	T55-L57 HydrophobicContact CG2-CD1 4.19Å; T55-N67 HydrophobicContact CG2-CB 4.19Å; T55-N67 WeakPolarHBondContact CG2-OD1 3.18Å; T55-N69 WeakPolarHBondContact CB-OD1 3.42Å; T55-N69 VanDerWaalsContact CG2-OD1 3.29Å; T55-N69 WeakPolarHBondContact CG2-OD1 3.28Å; T55-N69 PolarHBondContact OG1-OD1 3.28Å
56	L	42.7	Very low	40	Very low	43 Å²	43	83.4 Å²	83.4	23%	0.225	45%	0.446	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	101.5	171.2	-180	79.3	0	0	0	109.6	I58 L68 Y70 I106	L56-I58 HydrophobicContact CD2-CD1 4.02Å; L56-I58 HydrophobicContact CD2-CG1 3.99Å; L56-I58 HydrophobicContact CG-CG1 4.12Å; L56-I58 PolarHBondContact O-N 3.4Å; L56-L68 HydrophobicContact CB-CB 4.12Å; L56-L68 HydrophobicContact CD2-CB 4.45Å; L56-L68 HydrophobicContact CD2-CD1 4.35Å; L56-L68 PolarHBondContact N-O 3.04Å; L56-L68 PolarHBondContact O-N 3.06Å; L56-Y70 HydrophobicContact CB-CE1 4.13Å; L56-I106 HydrophobicContact CD1-CG2 4.09Å
57	L	39.5	Very low	40.1	Very low	84 Å²	84	83.1 Å²	83.1	44%	0.44	45%	0.445	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	119.8	164.8	-97.1	94.7	0	0	0	109.9	T55 Y65 N67	T55-L57 HydrophobicContact CG2-CD1 4.19Å; L57-Y65 HydrophobicContact CD2-CD1 3.94Å; L57-Y65 HydrophobicContact CD2-CG 4.15Å; L57-N67 WeakPolarHBondContact CD1-OD1 3.2Å; L57-N67 VanDerWaalsContact CG-OD1 3.25Å; L57-N67 WeakPolarHBondContact CG-OD1 3.27Å
58	I	42.1	Very low	40.5	Very low	31 Å²	31	75.4 Å²	75.4	16%	0.159	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	114.7	165.3	-58.3	-176.7	0	0	0	107.9	L56 L60 Y65 M66 L68	L56-I58 HydrophobicContact CD2-CD1 4.02Å; L56-I58 HydrophobicContact CD2-CG1 3.99Å; L56-I58 HydrophobicContact CG-CG1 4.12Å; L56-I58 PolarHBondContact O-N 3.4Å; I58-L60 HydrophobicContact CG2-CD2 3.99Å; I58-Y65 CarbonylContact O-C 3.53Å; I58-Y65 WeakPolarHBondContact O-CA 3.47Å; I58-M66 HydrophobicContact CB-CB 4.4Å; I58-M66 PolarHBondContact N-O 3.13Å; I58-M66 PolarHBondContact O-N 3.03Å; I58-L68 HydrophobicContact CD1-CD1 3.72Å
59	S	37.7	Very low	40.6	Very low	67 Å²	67	78.9 Å²	78.9	47%	0.469	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	129.5	167.1	-168.9	0	0	0	0	109.9	Y65	S59-Y65 WeakPolarHBondContact OG-CE1 3.04Å
60	L	38.9	Very low	40.6	Very low	66 Å²	66	75.2 Å²	75.2	35%	0.346	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	1	176.9	-59.1	178.6	0	0	0	112.4	I58 I64 M66 L96	I58-L60 HydrophobicContact CG2-CD2 3.99Å; L60-I64 HydrophobicContact CB-CB 4.29Å; L60-I64 HydrophobicContact CB-CG2 4.31Å; L60-I64 HydrophobicContact CD1-CG2 4.02Å; L60-I64 PolarHBondContact N-O 3.42Å; L60-M66 HydrophobicContact CD1-CB 4.25Å; L60-M66 HydrophobicContact CD1-CE 4.48Å; L60-M66 HydrophobicContact CG-CB 4.5Å; L60-L96 HydrophobicContact CD2-CD2 4.41Å
61	G	32.6	Very low	40.4	Very low	31 Å²	31	71.2 Å²	71.2	32%	0.32	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	91.1	169.7	-168.9	0	0	0	0	0	112.7	A63 I64	G61-A63 VanDerWaalsContact C-N 3.27Å; G61-A63 PolarHBondContact O-N 3.18Å; G61-A63 VanDerWaalsContact O-N 3.15Å; G61-I64 WeakPolarHBondContact O-CB 3.42Å; G61-I64 PolarHBondContact O-N 2.88Å
62	N	32.5	Very low	40.3	Very low	162 Å²	162	67.1 Å²	67.1	87%	0.866	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.1	39.9	177.4	-63.3	-1.6	0	0	0	115.1	I64	N62-I64 PolarHBondContact O-N 3.01Å; N62-I64 VanDerWaalsContact O-N 3.1Å
63	A	34.1	Very low	40.1	Very low	64 Å²	64	67.6 Å²	67.6	53%	0.529	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.5	12.4	-174.4	0	0	0	0	0	115.8	G61 Y65	G61-A63 VanDerWaalsContact C-N 3.27Å; G61-A63 PolarHBondContact O-N 3.18Å; G61-A63 VanDerWaalsContact O-N 3.15Å; A63-Y65 VanDerWaalsContact O-CD2 3.23Å; A63-Y65 WeakPolarHBondContact O-CD2 3.35Å; A63-Y65 VanDerWaalsContact O-CE2 3.31Å; A63-Y65 WeakPolarHBondContact O-CE2 3.04Å
64	I	33.7	Very low	40.2	Very low	99 Å²	99	61.6 Å²	61.6	51%	0.508	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	128.7	171.5	-51.2	177.2	0	0	0	108.6	L60 G61 N62	L60-I64 HydrophobicContact CB-CB 4.29Å; L60-I64 HydrophobicContact CB-CG2 4.31Å; L60-I64 HydrophobicContact CD1-CG2 4.02Å; L60-I64 PolarHBondContact N-O 3.42Å; G61-I64 WeakPolarHBondContact O-CB 3.42Å; G61-I64 PolarHBondContact O-N 2.88Å; N62-I64 PolarHBondContact O-N 3.01Å; N62-I64 VanDerWaalsContact O-N 3.1Å
65	Y	40	Very low	40.2	Very low	130 Å²	130	68.3 Å²	68.3	51%	0.51	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	146	174.7	-57.1	-86.6	0	0	0	110	L57 I58 S59 A63	L57-Y65 HydrophobicContact CD2-CD1 3.94Å; L57-Y65 HydrophobicContact CD2-CG 4.15Å; I58-Y65 CarbonylContact O-C 3.53Å; I58-Y65 WeakPolarHBondContact O-CA 3.47Å; S59-Y65 WeakPolarHBondContact OG-CE1 3.04Å; A63-Y65 VanDerWaalsContact O-CD2 3.23Å; A63-Y65 WeakPolarHBondContact O-CD2 3.35Å; A63-Y65 VanDerWaalsContact O-CE2 3.31Å; A63-Y65 WeakPolarHBondContact O-CE2 3.04Å
66	M	40.7	Very low	39.9	Very low	45 Å²	45	68.7 Å²	68.7	22%	0.222	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	123.1	171	168.8	-175.8	-72.9	0	0	107.8	I58 L60 L68 F88	I58-M66 HydrophobicContact CB-CB 4.4Å; I58-M66 PolarHBondContact N-O 3.13Å; I58-M66 PolarHBondContact O-N 3.03Å; L60-M66 HydrophobicContact CD1-CB 4.25Å; L60-M66 HydrophobicContact CD1-CE 4.48Å; L60-M66 HydrophobicContact CG-CB 4.5Å; M66-L68 HydrophobicContact CG-CG 4.47Å; M66-L68 HydrophobicContact SD-CD1 4.26Å; M66-L68 HydrophobicContact SD-CG 4.48Å; M66-F88 HydrophobicContact CE-CE2 4.22Å; M66-F88 HydrophobicContact CE-CZ 4.29Å
67	N	40.9	Very low	39.4	Very low	40 Å²	40	69.9 Å²	69.9	21%	0.214	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	135	168.9	-90.7	-24.7	0	0	0	110.2	T55 L57 Y444	T55-N67 HydrophobicContact CG2-CB 4.19Å; T55-N67 WeakPolarHBondContact CG2-OD1 3.18Å; L57-N67 WeakPolarHBondContact CD1-OD1 3.2Å; L57-N67 VanDerWaalsContact CG-OD1 3.25Å; L57-N67 WeakPolarHBondContact CG-OD1 3.27Å; N67-Y444 PolarHBondContact ND2-OH 2.98Å
68	L	41.8	Very low	39	Very low	41 Å²	41	67.2 Å²	67.2	22%	0.215	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	93.6	169.5	-85.9	163.9	0	0	0	108.5	L56 I58 M66	L56-L68 HydrophobicContact CB-CB 4.12Å; L56-L68 HydrophobicContact CD2-CB 4.45Å; L56-L68 HydrophobicContact CD2-CD1 4.35Å; L56-L68 PolarHBondContact N-O 3.04Å; L56-L68 PolarHBondContact O-N 3.06Å; I58-L68 HydrophobicContact CD1-CD1 3.72Å; M66-L68 HydrophobicContact CG-CG 4.47Å; M66-L68 HydrophobicContact SD-CD1 4.26Å; M66-L68 HydrophobicContact SD-CG 4.48Å
69	N	44.4	Very low	38.5	Very low	95 Å²	95	69.5 Å²	69.5	51%	0.508	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	131.8	172.3	-69.2	-11.7	0	0	0	109.6	T55	T55-N69 WeakPolarHBondContact CB-OD1 3.42Å; T55-N69 VanDerWaalsContact CG2-OD1 3.29Å; T55-N69 WeakPolarHBondContact CG2-OD1 3.28Å; T55-N69 PolarHBondContact OG1-OD1 3.28Å
70	Y	44	Very low	38.3	Very low	31 Å²	31	70.9 Å²	70.9	12%	0.122	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	150.4	170.3	62.5	-96.5	0	0	0	111.4	V54 L56 V72 V78	V54-Y70 HydrophobicContact CB-CD2 4.07Å; V54-Y70 HydrophobicContact CB-CE1 4.15Å; V54-Y70 HydrophobicContact CB-CE2 3.65Å; V54-Y70 HydrophobicContact CG1-CE1 4.01Å; V54-Y70 HydrophobicContact CG1-CE2 4.07Å; V54-Y70 WeakPolarHBondContact CG1-OH 3.36Å; V54-Y70 HydrophobicContact CG2-CE2 4.07Å; V54-Y70 PolarHBondContact N-O 2.87Å; V54-Y70 WeakPolarHBondContact O-CD1 3.12Å; V54-Y70 PolarHBondContact O-N 3.47Å; L56-Y70 HydrophobicContact CB-CE1 4.13Å; Y70-V72 HydrophobicContact CD2-CG2 3.91Å; Y70-V72 HydrophobicContact CE2-CG2 3.63Å; Y70-V78 HydrophobicContact CD2-CG1 3.39Å; Y70-V78 HydrophobicContact CE2-CG1 3.9Å; Y70-V78 HydrophobicContact CE2-CG2 4.48Å; Y70-V78 HydrophobicContact CG-CG1 3.94Å
71	T	42.2	Very low	37.9	Very low	20 Å²	20	71.8 Å²	71.8	12%	0.123	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	118.1	179.2	-47.1	0	0	0	0	109.2	H53 K73 E79	H53-T71 PolarHBondContact NE2-OG1 2.94Å; T71-K73 PolarHBondContact O-N 2.04Å; T71-E79 PolarHBondContact N-O 3.42Å; T71-E79 PolarHBondContact O-N 2.91Å
72	V	44.1	Very low	37.8	Very low	9 Å²	9	76.1 Å²	76.1	6%	0.055	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	104.1	169.3	-171.9	0	0	0	0	107.2	I46 N51 Y52 V54 Y70 V78	I46-V72 HydrophobicContact CD1-CG2 4.4Å; I46-V72 HydrophobicContact CG2-CG1 3.96Å; N51-V72 CarbonylContact C-O 3.4Å; N51-V72 VanDerWaalsContact CA-O 3.31Å; N51-V72 WeakPolarHBondContact CA-O 3.43Å; Y52-V72 PolarHBondContact N-O 2.85Å; Y52-V72 PolarHBondContact O-N 3.13Å; V54-V72 HydrophobicContact CG2-CG2 3.91Å; Y70-V72 HydrophobicContact CD2-CG2 3.91Å; Y70-V72 HydrophobicContact CE2-CG2 3.63Å; V72-V78 HydrophobicContact CG2-CG2 4.29Å
73	K	43.6	Very low	37.7	Very low	96 Å²	96	77.4 Å²	77.4	42%	0.417	40%	0.398	S	S	.	.			trans	-74.8	145	174.3	-75.5	177.5	174.8	171	0	110.4	N51 T71 E79	N51-K73 WeakPolarHBondContact OD1-CA 3.29Å; T71-K73 PolarHBondContact O-N 2.04Å; K73-E79 WeakPolarHBondContact CD-OE2 3.4Å; K73-E79 WeakPolarHBondContact CE-OE2 3.41Å; K73-E79 IonicContact NZ-OE2 3.57Å; K73-E79 PolarHBondContact NZ-OE2 3.07Å
74	A	44.8	Very low	37.4	Very low	27 Å²	27	79.6 Å²	79.6	22%	0.223	40%	0.401	C	S	.	.	S	Bend	trans	-57.4	141.5	178.6	0	0	0	0	0	111.1	N51 S76	N51-A74 PolarHBondContact OD1-N 3.45Å; A74-S76 PolarHBondContact O-N 2.86Å
75	F	43.9	Very low	37.1	Very low	182 Å²	182	80.3 Å²	80.3	80%	0.798	41%	0.412	S	S	*	.	S	Bend	trans	62.5	-23.3	176.9	-62.4	-84.1	0	0	0	119.1	T49	T49-F75 HydrophobicContact CG2-CZ 4.26Å
76	S	33.8	Very low	36.5	Very low	80 Å²	80	81 Å²	81	56%	0.559	42%	0.418	S	S	*	.	S	Bend	trans	-158	136.8	177.5	54.3	0	0	0	0	115.5	A74	A74-S76 PolarHBondContact O-N 2.86Å
77	S	33.4	Very low	35.8	Very low	67 Å²	67	87 Å²	87	47%	0.469	45%	0.445	S	S	.	.			trans	64.4	133.8	170.1	22.4	0	0	0	0	117.2
78	V	31	Very low	35.4	Very low	28 Å²	28	88.5 Å²	88.5	17%	0.17	45%	0.45	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	118.6	157.5	175.6	0	0	0	0	107.2	Y70 V72 I80	Y70-V78 HydrophobicContact CD2-CG1 3.39Å; Y70-V78 HydrophobicContact CE2-CG1 3.9Å; Y70-V78 HydrophobicContact CE2-CG2 4.48Å; Y70-V78 HydrophobicContact CG-CG1 3.94Å; V72-V78 HydrophobicContact CG2-CG2 4.29Å; V78-I80 HydrophobicContact CG1-CG1 4.13Å
79	E	30.2	Very low	34.8	Very low	79 Å²	79	90 Å²	90	37%	0.369	46%	0.461	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	123.9	166.7	-74.6	177.6	154.5	0	0	108.7	T71 K73 N81	T71-E79 PolarHBondContact N-O 3.42Å; T71-E79 PolarHBondContact O-N 2.91Å; K73-E79 WeakPolarHBondContact CD-OE2 3.4Å; K73-E79 WeakPolarHBondContact CE-OE2 3.41Å; K73-E79 IonicContact NZ-OE2 3.57Å; K73-E79 PolarHBondContact NZ-OE2 3.07Å; E79-N81 PolarHBondContact O-N 3.42Å
80	I	32.9	Very low	34.2	Very low	96 Å²	96	93.5 Å²	93.5	49%	0.492	47%	0.467	S	S	.	.			trans	-95.8	89.6	178.9	-51.2	177.1	0	0	0	107.2	V78 Q82	V78-I80 HydrophobicContact CG1-CG1 4.13Å; I80-Q82 HydrophobicContact CG2-CG 3.93Å; I80-Q82 PolarHBondContact O-N 2.89Å
81	N	32.4	Very low	33.6	Very low	86 Å²	86	94.1 Å²	94.1	46%	0.46	48%	0.482	S	S	.	.			trans	-75.4	89	176.3	-76.4	-2.1	0	0	0	110.1	E79 F83	E79-N81 PolarHBondContact O-N 3.42Å; N81-F83 HydrophobicContact CB-CD2 4.17Å; N81-F83 HydrophobicContact CB-CE2 4.01Å; N81-F83 PolarHBondContact O-N 3.11Å
82	Q	30.2	Very low	33.4	Very low	121 Å²	121	96.2 Å²	96.2	57%	0.565	49%	0.493	S	S	*	.			trans	-83.5	105.3	170.4	-59.8	-166.3	-83.8	0	0	109.9	I80	I80-Q82 HydrophobicContact CG2-CG 3.93Å; I80-Q82 PolarHBondContact O-N 2.89Å
83	F	29.8	Very low	33.1	Very low	189 Å²	189	100.4 Å²	100.4	83%	0.829	52%	0.515	S	S	*	.			trans	-95.2	-5.9	171.4	-81.7	-84.6	0	0	0	113.6	N81	N81-F83 HydrophobicContact CB-CD2 4.17Å; N81-F83 HydrophobicContact CB-CE2 4.01Å; N81-F83 PolarHBondContact O-N 3.11Å
84	D	28.3	Very low	32.8	Very low	110 Å²	110	98.3 Å²	98.3	59%	0.588	51%	0.508	S	S	*	.	S	Bend	trans	-69.8	133.9	178.7	-126.1	-40.3	0	0	0	111.7	F86	D84-F86 PolarHBondContact O-N 2.74Å; D84-F86 VanDerWaalsContact O-N 3.08Å
85	P	26.5	Very low	32.5	Very low	115 Å²	115	102.3 Å²	102.3	75%	0.747	52%	0.52	S	S	*	.	S	Bend	trans	-70.5	-4.3	-176.8	28.4	-36.6	0	0	0	114.6	H87	P85-H87 PolarHBondContact O-N 2.93Å
86	F	27.3	Very low	32.2	Very low	143 Å²	143	96.5 Å²	96.5	63%	0.627	50%	0.497	S	S	*	.			trans	-77.5	86.7	175.1	-70.2	-77.8	0	0	0	111.2	D84 F88	D84-F86 PolarHBondContact O-N 2.74Å; D84-F86 VanDerWaalsContact O-N 3.08Å; F86-F88 HydrophobicContact CB-CD2 3.98Å; F86-F88 HydrophobicContact CB-CE2 3.62Å; F86-F88 HydrophobicContact CB-CZ 4.37Å; F86-F88 HydrophobicContact CG-CE2 4.5Å; F86-F88 WeakPolarHBondContact O-CD2 3.28Å; F86-F88 PolarHBondContact O-N 3.31Å
87	H	26.8	Very low	32.3	Very low	172 Å²	172	95.7 Å²	95.7	80%	0.796	48%	0.482	S	S	*	.			trans	-70.4	65.6	-179.5	-156.3	-24.9	0	0	0	112.5	P85 T89	P85-H87 PolarHBondContact O-N 2.93Å; H87-T89 PolarHBondContact O-N 2.92Å
88	F	32.2	Very low	32.5	Very low	71 Å²	71	101.3 Å²	101.3	31%	0.311	49%	0.493	S	S	.	.			trans	-59.2	102.8	176.6	-73.4	-79.7	0	0	0	110.4	M66 F86 D92 L93	M66-F88 HydrophobicContact CE-CE2 4.22Å; M66-F88 HydrophobicContact CE-CZ 4.29Å; F86-F88 HydrophobicContact CB-CD2 3.98Å; F86-F88 HydrophobicContact CB-CE2 3.62Å; F86-F88 HydrophobicContact CB-CZ 4.37Å; F86-F88 HydrophobicContact CG-CE2 4.5Å; F86-F88 WeakPolarHBondContact O-CD2 3.28Å; F86-F88 PolarHBondContact O-N 3.31Å; F88-D92 HydrophobicContact CB-CB 4.47Å; F88-D92 HydrophobicContact CD1-CB 3.89Å; F88-L93 HydrophobicContact CB-CD1 4.45Å; F88-L93 HydrophobicContact CB-CG 4.23Å
89	T	28.3	Very low	32.7	Very low	72 Å²	72	106 Å²	106	44%	0.442	51%	0.513	S	S	.	.			trans	-68.4	169.1	173.7	75.9	0	0	0	0	109.7	H87 G91 D92 L93	H87-T89 PolarHBondContact O-N 2.92Å; T89-G91 PolarHBondContact O-N 2.83Å; T89-G91 WeakPolarHBondContact OG1-CA 3.3Å; T89-G91 PolarHBondContact OG1-N 2.92Å; T89-D92 WeakPolarHBondContact CA-OD2 3.4Å; T89-D92 WeakPolarHBondContact CB-OD2 3.47Å; T89-D92 WeakPolarHBondContact CG2-OD2 3.32Å; T89-D92 PolarHBondContact N-OD2 3.37Å; T89-D92 PolarHBondContact O-N 3.01Å; T89-D92 PolarHBondContact OG1-N 2.6Å; T89-D92 PolarHBondContact OG1-OD2 3.46Å; T89-L93 PolarHBondContact O-N 3.47Å
90	R	32.1	Very low	32.9	Very low	169 Å²	169	104.7 Å²	104.7	64%	0.638	51%	0.511	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.9	-22.5	165.7	-177.9	172.4	172.3	-168.2	-6.5	112.1	L94 Y128	R90-L94 HydrophobicContact CG-CD1 4.2Å; R90-L94 VanDerWaalsContact O-CB 3.25Å; R90-L94 WeakPolarHBondContact O-CB 3.38Å; R90-L94 WeakPolarHBondContact O-CD1 3.44Å; R90-L94 WeakPolarHBondContact O-CG 3.36Å; R90-Y128 PolarHBondContact NH2-O 2.94Å
91	G	32.8	Very low	32.7	Very low	44 Å²	44	108.6 Å²	108.6	45%	0.454	53%	0.527	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.4	-40.6	171.9	0	0	0	0	0	113.7	T89 L94 K95	T89-G91 PolarHBondContact O-N 2.83Å; T89-G91 WeakPolarHBondContact OG1-CA 3.3Å; T89-G91 PolarHBondContact OG1-N 2.92Å; G91-L94 CarbonylContact O-C 3.46Å; G91-L94 VanDerWaalsContact O-C 3.26Å; G91-L94 WeakPolarHBondContact O-CA 3.39Å; G91-L94 WeakPolarHBondContact O-CB 3.08Å; G91-L94 PolarHBondContact O-N 2.81Å; G91-K95 PolarHBondContact O-N 2.04Å
92	D	36.7	Very low	32.6	Very low	65 Å²	65	111 Å²	111	35%	0.348	53%	0.534	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.4	-40.9	-167.9	-53.8	-63.5	0	0	0	112.7	F88 T89 L94 K95 L96	F88-D92 HydrophobicContact CB-CB 4.47Å; F88-D92 HydrophobicContact CD1-CB 3.89Å; T89-D92 WeakPolarHBondContact CA-OD2 3.4Å; T89-D92 WeakPolarHBondContact CB-OD2 3.47Å; T89-D92 WeakPolarHBondContact CG2-OD2 3.32Å; T89-D92 PolarHBondContact N-OD2 3.37Å; T89-D92 PolarHBondContact O-N 3.01Å; T89-D92 PolarHBondContact OG1-N 2.6Å; T89-D92 PolarHBondContact OG1-OD2 3.46Å; D92-L94 PolarHBondContact O-N 2.89Å; D92-K95 CarbonylContact O-C 3.47Å; D92-K95 WeakPolarHBondContact O-CA 3.48Å; D92-K95 WeakPolarHBondContact O-CB 3.37Å; D92-K95 PolarHBondContact O-N 3.22Å; D92-L96 PolarHBondContact O-N 2.78Å
93	L	37.9	Very low	32.5	Very low	97 Å²	97	106.7 Å²	106.7	51%	0.508	52%	0.516	S	S	.	.	H	α-helix	trans	-58.5	-32.4	165	-87.5	163.4	0	0	0	111.5	F88 T89 K95 Y97	F88-L93 HydrophobicContact CB-CD1 4.45Å; F88-L93 HydrophobicContact CB-CG 4.23Å; T89-L93 PolarHBondContact O-N 3.47Å; L93-K95 VanDerWaalsContact C-N 3.32Å; L93-Y97 VanDerWaalsContact O-CB 3.27Å; L93-Y97 WeakPolarHBondContact O-CB 3.36Å; L93-Y97 PolarHBondContact O-N 3.4Å; L93-Y97 VanDerWaalsContact O-N 3.08Å
94	L	38.7	Very low	32.5	Very low	51 Å²	51	102.7 Å²	102.7	27%	0.267	50%	0.502	S	S	.	.	H	α-helix	trans	-83.1	-3.5	174.5	-74.1	-177	0	0	0	114.6	R90 G91 D92 R98 K126	R90-L94 HydrophobicContact CG-CD1 4.2Å; R90-L94 VanDerWaalsContact O-CB 3.25Å; R90-L94 WeakPolarHBondContact O-CB 3.38Å; R90-L94 WeakPolarHBondContact O-CD1 3.44Å; R90-L94 WeakPolarHBondContact O-CG 3.36Å; G91-L94 CarbonylContact O-C 3.46Å; G91-L94 VanDerWaalsContact O-C 3.26Å; G91-L94 WeakPolarHBondContact O-CA 3.39Å; G91-L94 WeakPolarHBondContact O-CB 3.08Å; G91-L94 PolarHBondContact O-N 2.81Å; D92-L94 PolarHBondContact O-N 2.89Å; L94-R98 WeakPolarHBondContact O-CD 3.43Å; L94-R98 VanDerWaalsContact O-CG 3.31Å; L94-R98 WeakPolarHBondContact O-CG 3.36Å; L94-K126 HydrophobicContact CD2-CD 4.46Å; L94-K126 VanDerWaalsContact CD2-CE 3.49Å; L94-K126 HydrophobicContact CD2-CG 4.48Å
95	K	36.6	Very low	32.6	Very low	112 Å²	112	99 Å²	99	49%	0.487	48%	0.484	S	S	.	.	H	α-helix	trans	-94.7	-49.7	169.1	-176.9	-176.3	171.6	-169	0	109.5	G91 D92 L93 Y97 R98 E99	G91-K95 PolarHBondContact O-N 2.04Å; D92-K95 CarbonylContact O-C 3.47Å; D92-K95 WeakPolarHBondContact O-CA 3.48Å; D92-K95 WeakPolarHBondContact O-CB 3.37Å; D92-K95 PolarHBondContact O-N 3.22Å; L93-K95 VanDerWaalsContact C-N 3.32Å; K95-Y97 VanDerWaalsContact C-N 3.3Å; K95-Y97 PolarHBondContact O-N 3.27Å; K95-R98 CarbonylContact O-C 3.49Å; K95-R98 WeakPolarHBondContact O-CA 3.04Å; K95-R98 WeakPolarHBondContact O-CB 3.48Å; K95-R98 PolarHBondContact O-N 3.4Å; K95-E99 WeakPolarHBondContact CE-OE1 3.04Å; K95-E99 VanDerWaalsContact CG-OE1 3.24Å; K95-E99 WeakPolarHBondContact CG-OE1 3.06Å; K95-E99 PolarHBondContact O-N 3.1Å
96	L	38.2	Very low	32.7	Very low	60 Å²	60	98.4 Å²	98.4	31%	0.314	47%	0.474	S	S	.	.	H	α-helix	trans	-50.2	-51.4	171	-141.2	83.7	0	0	0	110.7	L60 D92 R98 E99 T100	L60-L96 HydrophobicContact CD2-CD2 4.41Å; D92-L96 PolarHBondContact O-N 2.78Å; L96-R98 PolarHBondContact O-N 2.78Å; L96-E99 PolarHBondContact O-N 3.32Å; L96-E99 VanDerWaalsContact O-N 3.08Å; L96-T100 PolarHBondContact O-N 3.15Å; L96-T100 PolarHBondContact O-OG1 2.8Å
97	Y	36.5	Very low	32.9	Very low	62 Å²	62	96.2 Å²	96.2	24%	0.243	46%	0.462	C	S	.	.	H	α-helix	trans	-68.4	-13.8	177.1	-164.2	-86.6	0	0	0	114.6	L93 K95 T124	L93-Y97 VanDerWaalsContact O-CB 3.27Å; L93-Y97 WeakPolarHBondContact O-CB 3.36Å; L93-Y97 PolarHBondContact O-N 3.4Å; L93-Y97 VanDerWaalsContact O-N 3.08Å; K95-Y97 VanDerWaalsContact C-N 3.3Å; K95-Y97 PolarHBondContact O-N 3.27Å; Y97-T124 HydrophobicContact CE1-CG2 4.3Å; Y97-T124 WeakPolarHBondContact CE1-OG1 3.29Å; Y97-T124 HydrophobicContact CE2-CG2 4.31Å; Y97-T124 VanDerWaalsContact CZ-OG1 3.23Å; Y97-T124 PolarHBondContact OH-N 3.19Å; Y97-T124 PolarHBondContact OH-OG1 3.13Å
98	R	37.1	Very low	32.9	Very low	186 Å²	186	96.9 Å²	96.9	70%	0.702	46%	0.458	S	S	*	.	H	α-helix	trans	-89	-21.8	171.8	-89.4	177.4	162.4	172.4	-10.2	112.7	L94 K95 L96	L94-R98 WeakPolarHBondContact O-CD 3.43Å; L94-R98 VanDerWaalsContact O-CG 3.31Å; L94-R98 WeakPolarHBondContact O-CG 3.36Å; K95-R98 CarbonylContact O-C 3.49Å; K95-R98 WeakPolarHBondContact O-CA 3.04Å; K95-R98 WeakPolarHBondContact O-CB 3.48Å; K95-R98 PolarHBondContact O-N 3.4Å; L96-R98 PolarHBondContact O-N 2.78Å
99	E	35.6	Very low	32.7	Very low	127 Å²	127	96.7 Å²	96.7	59%	0.593	47%	0.469	S	S	*	.	H	α-helix	trans	-99.1	-28.3	-174.7	-71.6	165.4	-174.8	0	0	111.4	K95 L96	K95-E99 WeakPolarHBondContact CE-OE1 3.04Å; K95-E99 VanDerWaalsContact CG-OE1 3.24Å; K95-E99 WeakPolarHBondContact CG-OE1 3.06Å; K95-E99 PolarHBondContact O-N 3.1Å; L96-E99 PolarHBondContact O-N 3.32Å; L96-E99 VanDerWaalsContact O-N 3.08Å
100	T	33.6	Very low	32.9	Very low	51 Å²	51	104.7 Å²	104.7	31%	0.313	49%	0.492	S	S	.	.			trans	-85.7	131.3	170.3	58.5	0	0	0	0	112.4	L96	L96-T100 PolarHBondContact O-N 3.15Å; L96-T100 PolarHBondContact O-OG1 2.8Å
101	Q	30.1	Very low	32.7	Very low	178 Å²	178	104.5 Å²	104.5	83%	0.832	50%	0.503	S	S	*	.			trans	-100.9	28	178.1	-63	-167.7	13.4	0	0	112.8
102	F	29.4	Very low	32.4	Very low	137 Å²	137	108.7 Å²	108.7	60%	0.601	52%	0.52	S	S	*	.	S	Bend	trans	-130.3	150.7	-172.4	-36.3	-65.2	0	0	0	109.8
103	P	29	Very low	31.9	Very low	30 Å²	30	111.5 Å²	111.5	20%	0.195	54%	0.539	C	S	.	.			trans	-88.5	-172.3	178.1	43.1	-41.6	0	0	0	111.2	C120	P103-C120 WeakPolarHBondContact CD-O 3Å; P103-C120 HydrophobicContact CG-CB 4.07Å; P103-C120 WeakPolarHBondContact CG-O 3.44Å
104	I	29.9	Very low	31.2	Very low	105 Å²	105	115.8 Å²	115.8	54%	0.538	56%	0.557	S	S	.	*			trans	-119	115.8	-174.8	-59	159.6	0	0	0	108.5	I106	I104-I106 HydrophobicContact CG2-CG1 4.24Å
105	C	29.7	Very low	30.5	Very low	32 Å²	32	116.8 Å²	116.8	22%	0.216	57%	0.568	C	S	.	*			trans	-82	135.6	164.3	-62.1	0	0	0	0	108.9	Y107 C120	C105-Y107 HydrophobicContact CB-CD2 4.37Å; C105-Y107 HydrophobicContact CB-CE1 4.39Å; C105-Y107 HydrophobicContact CB-CE2 3.55Å; C105-Y107 WeakPolarHBondContact CB-OH 3.34Å; C105-C120 VanDerWaalsContact SG-SG 3.62Å
106	I	29.4	Very low	30	Very low	103 Å²	103	119.8 Å²	119.8	53%	0.528	58%	0.583	S	S	.	*			trans	-113.7	122.5	174.4	-59.6	175.3	0	0	0	107.6	I38 L56 I104	I38-I106 HydrophobicContact CG2-CD1 4.41Å; L56-I106 HydrophobicContact CD1-CG2 4.09Å; I104-I106 HydrophobicContact CG2-CG1 4.24Å
107	Y	29.7	Very low	29.5	Very low	97 Å²	97	122 Å²	122	38%	0.38	59%	0.589	S	S	.	*			trans	-115.7	157.1	177.8	-59	-62.4	0	0	0	111.2	C105 Y117 Y118	C105-Y107 HydrophobicContact CB-CD2 4.37Å; C105-Y107 HydrophobicContact CB-CE1 4.39Å; C105-Y107 HydrophobicContact CB-CE2 3.55Å; C105-Y107 WeakPolarHBondContact CB-OH 3.34Å; Y107-Y117 AromaticContact CD1-CD1 3.72Å; Y107-Y117 HydrophobicContact CD1-CD1 3.72Å; Y107-Y117 AromaticContact CD1-CE1 3.27Å; Y107-Y117 HydrophobicContact CD1-CE1 3.27Å; Y107-Y117 AromaticContact CD1-CZ 3.96Å; Y107-Y117 AromaticContact CD2-CD1 3.7Å; Y107-Y117 HydrophobicContact CD2-CD1 3.7Å; Y107-Y117 HydrophobicContact CD2-CD2 4.17Å; Y107-Y117 AromaticContact CD2-CE1 3.76Å; Y107-Y117 HydrophobicContact CD2-CE1 3.76Å; Y107-Y117 HydrophobicContact CD2-CE2 4.23Å; Y107-Y117 AromaticContact CD2-CG 3.91Å; Y107-Y117 HydrophobicContact CD2-CG 3.91Å; Y107-Y117 AromaticContact CE1-CD1 3.46Å; Y107-Y117 HydrophobicContact CE1-CD1 3.46Å; Y107-Y117 VanDerWaalsContact CE1-CD1 3.46Å; Y107-Y117 AromaticContact CE1-CE1 3.49Å; Y107-Y117 HydrophobicContact CE1-CE1 3.49Å; Y107-Y117 VanDerWaalsContact CE1-CE1 3.49Å; Y107-Y117 HydrophobicContact CE1-CG 4.48Å; Y107-Y117 AromaticContact CE2-CD1 3.43Å; Y107-Y117 HydrophobicContact CE2-CD1 3.43Å; Y107-Y117 VanDerWaalsContact CE2-CD1 3.43Å; Y107-Y117 HydrophobicContact CE2-CD2 4.34Å; Y107-Y117 AromaticContact CE2-CE1 3.94Å; Y107-Y117 HydrophobicContact CE2-CE1 3.94Å; Y107-Y117 AromaticContact CE2-CG 3.65Å; Y107-Y117 HydrophobicContact CE2-CG 3.65Å; Y107-Y117 AromaticContact CG-CD1 3.83Å; Y107-Y117 HydrophobicContact CG-CD1 3.83Å; Y107-Y117 AromaticContact CG-CE1 3.41Å; Y107-Y117 HydrophobicContact CG-CE1 3.41Å; Y107-Y117 VanDerWaalsContact CG-CE1 3.41Å; Y107-Y117 HydrophobicContact CG-CE2 4.29Å; Y107-Y117 HydrophobicContact CG-CG 4.43Å; Y107-Y117 AromaticContact CG-CZ 3.66Å; Y107-Y117 AromaticContact CZ-CD1 3.29Å; Y107-Y117 AromaticContact CZ-CE1 3.81Å; Y107-Y117 AromaticContact CZ-CG 3.96Å; Y107-Y118 PolarHBondContact OH-O 2.04Å
108	R	28.2	Very low	29	Very low	185 Å²	185	127.8 Å²	127.8	70%	0.698	61%	0.611	S	S	*	*			trans	-112.6	109.8	178	-165.2	-177.3	-167.5	178.8	3.7	107.5
109	A	28.4	Very low	28.6	Very low	68 Å²	68	124.6 Å²	124.6	56%	0.562	61%	0.614	S	S	*	*			trans	-67.2	173.7	165.4	0	0	0	0	0	110.4
110	W	31.1	Very low	28.2	Very low	240 Å²	240	122.5 Å²	122.5	91%	0.909	61%	0.613	S	S	*	*			trans	69.8	53.6	-177.5	-48.5	90.2	0	0	0	114.9
111	D	27.3	Very low	28.1	Very low	165 Å²	165	124.5 Å²	124.5	88%	0.882	63%	0.629	S	S	*	*	S	Bend		-135.7	141.2	124.4	-93.7	-40.5	0	0	0	106.4
112	T	27.3	Very low	28.1	Very low	132 Å²	132	120 Å²	120	81%	0.81	61%	0.611	S	S	*	*			trans	-83.6	162.9	-171.3	47.5	0	0	0	0	113.3
113	V	25.7	Very low	28.1	Very low	123 Å²	123	121.2 Å²	121.2	75%	0.745	61%	0.611	S	S	*	*	S	Bend	trans	75.2	105.5	172.4	-169.1	0	0	0	0	115.6
114	H	23.7	Very low	28.2	Very low	188 Å²	188	121.4 Å²	121.4	87%	0.87	61%	0.612	S	S	*	*			trans	60.6	102.5	166.8	-68.1	83.7	0	0	0	118.5
115	S	25.1	Very low	28.2	Very low	72 Å²	72	117.1 Å²	117.1	50%	0.503	59%	0.591	S	S	.	*			trans	-147.8	126.1	151.2	49.8	0	0	0	0	111.8	Y117	S115-Y117 PolarHBondContact OG-OH 2.94Å
116	Q	24.5	Very low	28.4	Very low	174 Å²	174	119.1 Å²	119.1	81%	0.813	60%	0.596	S	S	*	*			trans	-93.7	145.1	169.6	-66.9	171.3	-17.6	0	0	108.7
117	Y	27.8	Very low	28.4	Very low	108 Å²	108	121.3 Å²	121.3	42%	0.424	60%	0.602	S	S	.	*			trans	-120.1	141.5	-175.6	-67.6	-56	0	0	0	113.6	M1 Y107 S115	M1-Y117 HydrophobicContact CE-CE1 4.17Å; M1-Y117 VanDerWaalsContact CE-OH 3.29Å; M1-Y117 WeakPolarHBondContact CE-OH 3.38Å; Y107-Y117 AromaticContact CD1-CD1 3.72Å; Y107-Y117 HydrophobicContact CD1-CD1 3.72Å; Y107-Y117 AromaticContact CD1-CE1 3.27Å; Y107-Y117 HydrophobicContact CD1-CE1 3.27Å; Y107-Y117 AromaticContact CD1-CZ 3.96Å; Y107-Y117 AromaticContact CD2-CD1 3.7Å; Y107-Y117 HydrophobicContact CD2-CD1 3.7Å; Y107-Y117 HydrophobicContact CD2-CD2 4.17Å; Y107-Y117 AromaticContact CD2-CE1 3.76Å; Y107-Y117 HydrophobicContact CD2-CE1 3.76Å; Y107-Y117 HydrophobicContact CD2-CE2 4.23Å; Y107-Y117 AromaticContact CD2-CG 3.91Å; Y107-Y117 HydrophobicContact CD2-CG 3.91Å; Y107-Y117 AromaticContact CE1-CD1 3.46Å; Y107-Y117 HydrophobicContact CE1-CD1 3.46Å; Y107-Y117 VanDerWaalsContact CE1-CD1 3.46Å; Y107-Y117 AromaticContact CE1-CE1 3.49Å; Y107-Y117 HydrophobicContact CE1-CE1 3.49Å; Y107-Y117 VanDerWaalsContact CE1-CE1 3.49Å; Y107-Y117 HydrophobicContact CE1-CG 4.48Å; Y107-Y117 AromaticContact CE2-CD1 3.43Å; Y107-Y117 HydrophobicContact CE2-CD1 3.43Å; Y107-Y117 VanDerWaalsContact CE2-CD1 3.43Å; Y107-Y117 HydrophobicContact CE2-CD2 4.34Å; Y107-Y117 AromaticContact CE2-CE1 3.94Å; Y107-Y117 HydrophobicContact CE2-CE1 3.94Å; Y107-Y117 AromaticContact CE2-CG 3.65Å; Y107-Y117 HydrophobicContact CE2-CG 3.65Å; Y107-Y117 AromaticContact CG-CD1 3.83Å; Y107-Y117 HydrophobicContact CG-CD1 3.83Å; Y107-Y117 AromaticContact CG-CE1 3.41Å; Y107-Y117 HydrophobicContact CG-CE1 3.41Å; Y107-Y117 VanDerWaalsContact CG-CE1 3.41Å; Y107-Y117 HydrophobicContact CG-CE2 4.29Å; Y107-Y117 HydrophobicContact CG-CG 4.43Å; Y107-Y117 AromaticContact CG-CZ 3.66Å; Y107-Y117 AromaticContact CZ-CD1 3.29Å; Y107-Y117 AromaticContact CZ-CE1 3.81Å; Y107-Y117 AromaticContact CZ-CG 3.96Å; S115-Y117 PolarHBondContact OG-OH 2.94Å
118	Y	27.6	Very low	28.4	Very low	182 Å²	182	124.5 Å²	124.5	71%	0.714	61%	0.614	S	S	*	*			trans	-126.7	140.6	178	-72.3	-98.4	0	0	0	110	Y107	Y107-Y118 PolarHBondContact OH-O 2.04Å
119	P	27.9	Very low	28.6	Very low	119 Å²	119	123.6 Å²	123.6	77%	0.773	62%	0.622	S	S	*	*			trans	-81.9	156.7	177.3	33.3	-34.9	0	0	0	113.5
120	C	27.5	Very low	28.9	Very low	83 Å²	83	127.6 Å²	127.6	56%	0.561	63%	0.627	S	S	*	*			trans	-113.4	-164.7	-171.8	-69.4	0	0	0	0	115.3	P103 C105	P103-C120 WeakPolarHBondContact CD-O 3Å; P103-C120 HydrophobicContact CG-CB 4.07Å; P103-C120 WeakPolarHBondContact CG-O 3.44Å; C105-C120 VanDerWaalsContact SG-SG 3.62Å
121	S	30.5	Very low	29.1	Very low	94 Å²	94	124 Å²	124	66%	0.657	62%	0.618	S	S	*	*			trans	-127.6	150.6	165.5	46.1	0	0	0	0	109.6
122	D	30.6	Very low	29.5	Very low	84 Å²	84	120.9 Å²	120.9	45%	0.449	60%	0.598	S	S	.	*			cis	-150.5	-166.4	0.8	-62.8	-54.4	0	0	0	110.3
123	R	29.8	Very low	29.9	Very low	162 Å²	162	120.2 Å²	120.2	61%	0.611	59%	0.586	S	S	*	*			trans	77.8	117.4	138.8	-72.1	154.6	-139.2	-149	7	122	I31	I31-R123 HydrophobicContact CD1-CB 4.4Å; I31-R123 HydrophobicContact CD1-CG 4.23Å
124	T	30.6	Very low	30.4	Very low	33 Å²	33	124.3 Å²	124.3	20%	0.202	59%	0.588	C	S	.	*			trans	-134.2	-140.4	140.8	73.1	0	0	0	0	109.7	I31 L33 Y97	I31-T124 PolarHBondContact N-O 3.03Å; I31-T124 CarbonylContact O-C 3.43Å; I31-T124 WeakPolarHBondContact O-CA 3.37Å; L33-T124 HydrophobicContact CB-CG2 3.86Å; L33-T124 HydrophobicContact CD1-CG2 3.99Å; L33-T124 HydrophobicContact CG-CG2 4.06Å; Y97-T124 HydrophobicContact CE1-CG2 4.3Å; Y97-T124 WeakPolarHBondContact CE1-OG1 3.29Å; Y97-T124 HydrophobicContact CE2-CG2 4.31Å; Y97-T124 VanDerWaalsContact CZ-OG1 3.23Å; Y97-T124 PolarHBondContact OH-N 3.19Å; Y97-T124 PolarHBondContact OH-OG1 3.13Å
125	P	30.4	Very low	30.7	Very low	15 Å²	15	122.8 Å²	122.8	10%	0.097	59%	0.585	C	S	.	*			cis	-133.3	176.9	-11.1	43.3	-26.6	0	0	0	118.1	Y30	Y30-P125 HydrophobicContact CD1-CG 3.99Å; Y30-P125 HydrophobicContact CD2-CG 4.39Å; Y30-P125 HydrophobicContact CE1-CG 4.19Å; Y30-P125 VanDerWaalsContact CG-CD 3.44Å; Y30-P125 HydrophobicContact CG-CG 4.08Å
126	K	32.5	Very low	31	Very low	75 Å²	75	126.1 Å²	126.1	33%	0.326	60%	0.598	S	S	.	*			trans	70.6	121	139.2	-84.4	164	169.2	152.9	0	126.4	L94	L94-K126 HydrophobicContact CD2-CD 4.46Å; L94-K126 VanDerWaalsContact CD2-CE 3.49Å; L94-K126 HydrophobicContact CD2-CG 4.48Å
127	K	29.9	Very low	31.3	Very low	149 Å²	149	125.6 Å²	125.6	65%	0.648	60%	0.595	S	S	*	*			trans	179.7	160.8	137.6	-104.1	167	163	-161.1	0	109.1
128	Y	30.8	Very low	31.3	Very low	164 Å²	164	127.2 Å²	127.2	64%	0.643	61%	0.61	S	S	*	*			cis	-127	-148.5	-8.1	-73.2	-81	0	0	0	111.2	R90	R90-Y128 PolarHBondContact NH2-O 2.94Å
129	L	32.3	Very low	31.7	Very low	166 Å²	166	123.7 Å²	123.7	87%	0.869	61%	0.609	S	S	*	*			trans	-130.1	-178	-161.4	-84.8	93.1	0	0	0	118.2
130	K	33.3	Very low	31.7	Very low	152 Å²	152	125.3 Å²	125.3	66%	0.661	61%	0.609	S	S	*	*			trans	-73.8	-159.6	-165.7	-138.6	-164.1	168.9	-172.5	0	115.3	E132 E133	K130-E132 HydrophobicContact CD-CG 4.3Å; K130-E132 WeakPolarHBondContact CD-OE1 3.4Å; K130-E132 VanDerWaalsContact NZ-CG 3.31Å; K130-E132 IonicContact NZ-OE1 2.66Å; K130-E132 PolarHBondContact NZ-OE1 3.36Å; K130-E133 IonicContact NZ-OE1 3.59Å
131	K	35.9	Very low	31.5	Very low	164 Å²	164	128.4 Å²	128.4	71%	0.713	62%	0.62	S	S	*	*			cis	-167.1	134.7	37.8	-137.3	-150.3	-171.9	-138.5	0	115.2
132	E	36.5	Very low	31.3	Very low	99 Å²	99	129.9 Å²	129.9	46%	0.463	62%	0.624	S	S	.	*			trans	47.8	159.7	131.6	-72.5	161.1	-136.8	0	0	125.4	K130	K130-E132 HydrophobicContact CD-CG 4.3Å; K130-E132 WeakPolarHBondContact CD-OE1 3.4Å; K130-E132 VanDerWaalsContact NZ-CG 3.31Å; K130-E132 IonicContact NZ-OE1 2.66Å; K130-E132 PolarHBondContact NZ-OE1 3.36Å
133	E	35.8	Very low	31	Very low	119 Å²	119	133.5 Å²	133.5	56%	0.556	64%	0.643	S	S	*	*			cis	177.7	163.7	-28.4	-140.3	156.3	-115.6	0	0	114	K130	K130-E133 IonicContact NZ-OE1 3.59Å
134	W	35.9	Very low	30.9	Very low	209 Å²	209	133 Å²	133	79%	0.792	65%	0.65	S	S	*	*			trans	66.6	162.9	161.3	-53.1	119.4	0	0	0	122.1
135	L	29	Very low	30.5	Very low	155 Å²	155	141.1 Å²	141.1	81%	0.812	68%	0.683	S	S	*	*			cis	-155.9	-171.2	-11.2	-122.6	166	0	0	0	112.3
136	D	32.3	Very low	30.4	Very low	143 Å²	143	149.3 Å²	149.3	77%	0.765	72%	0.72	S	S	*	*			trans	-142.4	173.6	-151.5	-148.5	-16.2	0	0	0	117.8
137	Q	31.3	Very low	30	Very low	163 Å²	163	154.2 Å²	154.2	76%	0.762	75%	0.749	S	S	*	*			trans	71.6	167.8	160.7	-117.6	-179.5	105.4	0	0	119.6
138	I	26.5	Very low	30	Very low	142 Å²	142	156.5 Å²	156.5	73%	0.728	76%	0.759	S	S	*	*			cis	-149.3	155.7	5.7	-30.6	156.7	0	0	0	111.6
139	P	35.8	Very low	29.9	Very low	107 Å²	107	154.8 Å²	154.8	70%	0.695	77%	0.768	S	S	*	*			trans	-135.4	-179.7	176.8	44	-29.2	0	0	0	119.3
140	I	29.1	Very low	29.7	Very low	153 Å²	153	156.4 Å²	156.4	79%	0.785	77%	0.771	S	S	*	*			trans	87.4	123.6	159.7	-56	163.5	0	0	0	120.9
141	L	23.2	Very low	29.5	Very low	149 Å²	149	160.7 Å²	160.7	78%	0.78	78%	0.783	S	S	*	*				-169.7	158.6	122.3	-132.2	94	0	0	0	113.8
142	V	26.3	Very low	29.2	Very low	124 Å²	124	162.7 Å²	162.7	75%	0.752	79%	0.792	S	S	*	*			trans	-145.8	147.3	177.8	176.6	0	0	0	0	111
143	L	23.2	Very low	28.8	Very low	160 Å²	160	168.7 Å²	168.7	84%	0.838	81%	0.812	S	S	*	*			trans	-143.5	146.8	172	-85.4	170.8	0	0	0	112.9
144	I	27.5	Very low	28.6	Very low	151 Å²	151	173.5 Å²	173.5	77%	0.774	83%	0.826	S	S	*	*			trans	-143.1	150.9	177.1	-55.5	177.7	0	0	0	109.4
145	K	23.7	Very low	28.2	Very low	204 Å²	204	168 Å²	168	89%	0.887	82%	0.82	S	S	*	*			trans	-149.4	149.7	170.3	-115.7	179	-175.1	178.9	0	113.1
146	Q	27	Very low	28.2	Very low	187 Å²	187	169.9 Å²	169.9	87%	0.874	82%	0.824	S	S	*	*			trans	-147.5	161.9	170.6	-77.2	-167.3	-10.8	0	0	110.3
147	L	25.7	Very low	28	Very low	178 Å²	178	166.1 Å²	166.1	93%	0.932	82%	0.819	S	S	*	*			trans	-157.9	176	167.2	-107.3	165.4	0	0	0	112.2
148	K	29.3	Very low	28	Very low	198 Å²	198	165.9 Å²	165.9	86%	0.861	82%	0.821	S	S	*	*			trans	-114.6	168.2	-153.7	-81.1	-177.9	177.7	178.7	0	116.8
149	P	27.9	Very low	28	Very low	127 Å²	127	166.8 Å²	166.8	83%	0.825	83%	0.827	S	S	*	*			trans	-102.1	-177.4	-167.7	40.8	-37.7	0	0	0	116.7
150	Q	28.9	Very low	27.7	Very low	201 Å²	201	173.7 Å²	173.7	94%	0.939	84%	0.839	S	S	*	*			trans	-104.6	168.3	-178.7	-75.3	-164.4	-8.2	0	0	115.8
151	R	29.7	Very low	27.7	Very low	241 Å²	241	172.2 Å²	172.2	91%	0.909	83%	0.833	S	S	*	*			trans	-109.8	132.2	174.9	-91.7	-177	168.6	-178.6	-2.8	112.8
152	K	29.2	Very low	28.1	Very low	206 Å²	206	172.4 Å²	172.4	90%	0.896	83%	0.83	S	S	*	*				-174	131.4	125.3	-107.2	177	-179.6	-179	0	109.5
153	Y	28.4	Very low	28.3	Very low	226 Å²	226	175.4 Å²	175.4	89%	0.886	83%	0.832	S	S	*	*			trans	-124.7	134	170.7	-112.6	-86.9	0	0	0	108.1
154	Y	31.1	Very low	28.4	Very low	219 Å²	219	175.4 Å²	175.4	86%	0.859	83%	0.833	S	S	*	*			trans	-107.4	145.4	152	-100.6	-91	0	0	0	107.4	H156	Y154-H156 PolarHBondContact O-N 3.25Å
155	S	27.2	Very low	28.5	Very low	95 Å²	95	175.7 Å²	175.7	66%	0.664	83%	0.834	S	S	*	*			trans	-72	121.3	178.4	49	0	0	0	0	111.1
156	H	28.5	Very low	28.6	Very low	193 Å²	193	172.5 Å²	172.5	89%	0.894	83%	0.826	S	S	*	*				169	139	126.6	-91	-69.2	0	0	0	109.8	Y154	Y154-H156 PolarHBondContact O-N 3.25Å
157	G	29.1	Very low	28.7	Very low	64 Å²	64	169.7 Å²	169.7	66%	0.66	82%	0.816	S	S	*	*			trans	128.6	97.1	159.8	0	0	0	0	0	117.3
158	I	30.1	Very low	29	Very low	158 Å²	158	169.5 Å²	169.5	81%	0.81	81%	0.808	S	S	*	*			trans	73.6	108.3	133	-62.6	161.5	0	0	0	118.4
159	L	27.3	Very low	29	Very low	161 Å²	161	167.3 Å²	167.3	84%	0.843	80%	0.801	S	S	*	*			trans	43.7	113.2	147.6	-81.5	68.9	0	0	0	119.6
160	W	29	Very low	29.4	Very low	253 Å²	253	169.2 Å²	169.2	96%	0.958	80%	0.798	S	S	*	*			trans	-87.3	139.4	140.3	-91.8	70.9	0	0	0	110.2
161	D	29.3	Very low	29.5	Very low	122 Å²	122	167.1 Å²	167.1	65%	0.652	79%	0.794	S	S	*	*			trans	-86.8	116.9	167.9	-179.2	11.9	0	0	0	109.5
162	H	31.8	Very low	29.6	Very low	153 Å²	153	162 Å²	162	71%	0.708	79%	0.793	S	S	*	*				175.7	124.7	121.4	-86.1	-19.1	0	0	0	113.3
163	K	29.9	Very low	29.9	Very low	186 Å²	186	161.6 Å²	161.6	81%	0.809	79%	0.792	S	S	*	*			trans	63.2	91.4	156.3	-62.5	-178.6	179.2	176.1	0	119.4
164	L	25.6	Very low	30.1	Very low	161 Å²	161	157.7 Å²	157.7	84%	0.843	79%	0.786	S	S	*	*				55	154.3	124	-92	77.1	0	0	0	122.1
165	I	30	Very low	30.1	Very low	156 Å²	156	154.4 Å²	154.4	80%	0.8	78%	0.783	S	S	*	*			trans	86.8	121.8	175.1	-52.2	166.1	0	0	0	113.1
166	L	26.6	Very low	30.5	Very low	138 Å²	138	158.1 Å²	158.1	72%	0.723	79%	0.794	S	S	*	*			cis	170.7	138	-26.1	-108.2	164.7	0	0	0	106.4
167	L	27.7	Very low	30.5	Very low	128 Å²	128	153.8 Å²	153.8	67%	0.67	78%	0.784	S	S	*	*			trans	83.8	140.9	154.6	-61.3	161.1	0	0	0	122
168	F	31.6	Very low	30.9	Very low	174 Å²	174	156.8 Å²	156.8	76%	0.763	79%	0.792	S	S	*	*			trans	63.6	113.5	165.5	-49.3	-55.5	0	0	0	118.1
169	E	29.7	Very low	31.2	Very low	152 Å²	152	156 Å²	156	71%	0.71	79%	0.789	S	S	*	*			cis	107.8	140.9	10.7	-159.1	175	-149.9	0	0	115.5
170	H	37.5	Very low	31.3	Very low	166 Å²	166	155 Å²	155	77%	0.769	78%	0.775	S	S	*	*			trans	84	117	172.6	-63.6	-55.5	0	0	0	121.8
171	D	31.1	Very low	31.6	Very low	158 Å²	158	150.5 Å²	150.5	85%	0.845	76%	0.762	S	S	*	*			trans	-74.9	167.6	156.8	-44.4	-95.3	0	0	0	112.8
172	C	30.3	Very low	32	Very low	133 Å²	133	153.1 Å²	153.1	90%	0.899	76%	0.764	S	S	*	*			trans	-152.2	150.7	145.4	-157.7	0	0	0	0	112.7
173	F	35.1	Very low	32	Very low	198 Å²	198	156.8 Å²	156.8	87%	0.868	77%	0.772	S	S	*	*			trans	-111.9	171.6	-175.1	-124.9	-106.2	0	0	0	111.7
174	N	33.7	Very low	32.4	Very low	143 Å²	143	153.1 Å²	153.1	77%	0.765	77%	0.767	S	S	*	*			trans	-62.5	140.8	175.3	-62.9	-65.1	0	0	0	113.4
175	L	31.4	Very low	32.8	Very low	150 Å²	150	152.8 Å²	152.8	79%	0.785	77%	0.765	S	S	*	*			trans	-177.2	144.9	151.9	-108.2	159.9	0	0	0	113
176	I	35	Very low	33.1	Very low	174 Å²	174	156.2 Å²	156.2	89%	0.892	77%	0.768	S	S	*	*			trans	-175.4	149.1	144.5	-98.3	155.4	0	0	0	109.1
177	C	29.6	Very low	33.6	Very low	102 Å²	102	156.8 Å²	156.8	69%	0.689	78%	0.777	S	S	*	*			trans	-131.5	168.6	-164.4	-67.2	0	0	0	0	113.9
178	P	37.8	Very low	34	Very low	127 Å²	127	154.5 Å²	154.5	83%	0.825	79%	0.785	S	S	*	*			trans	-97.8	162.3	-178.8	38.6	-36.2	0	0	0	115.1
179	D	34.3	Very low	34.3	Very low	140 Å²	140	156.1 Å²	156.1	75%	0.749	79%	0.792	S	S	*	*			trans	-167.3	172.7	158.8	-148.8	10.2	0	0	0	107.8
180	Y	30.8	Very low	34.6	Very low	141 Å²	141	158.8 Å²	158.8	55%	0.553	80%	0.801	S	S	*	*			cis	-169.7	158.6	10.7	-170	32.2	0	0	0	109.4
181	K	35.6	Very low	34.8	Very low	159 Å²	159	156.9 Å²	156.9	69%	0.691	81%	0.805	S	S	*	*			trans	147.8	143.7	131.2	-75.6	143.2	-155	118.2	0	118.5
182	Y	36.8	Very low	35.1	Very low	176 Å²	176	158.4 Å²	158.4	69%	0.69	81%	0.807	S	S	*	*			trans	20.7	91.1	151	-54.8	-60.5	0	0	0	125.3
183	R	32.5	Very low	36.1	Very low	230 Å²	230	161.5 Å²	161.5	87%	0.868	81%	0.806	S	S	*	*				52.2	162	107.7	-70.3	-172.7	-174.4	-154.1	3	122.6
184	P	38.2	Very low	37.4	Very low	109 Å²	109	154.4 Å²	154.4	71%	0.708	78%	0.777	S	S	*	*			cis	-148.3	166.7	-24.6	39.3	-18.2	0	0	0	120.6
185	L	34.3	Very low	39	Very low	155 Å²	155	153.1 Å²	153.1	81%	0.812	77%	0.769	S	S	*	*			trans	74	111.5	143.6	-71	161.5	0	0	0	128.5
186	R	35.1	Very low	41.3	Very low	228 Å²	228	148.9 Å²	148.9	86%	0.86	75%	0.747	S	S	*	*			trans	57.8	109.8	132.9	-70.3	-169.4	-178.1	-152.8	2.2	129.7
187	V	37.5	Very low	43.5	Very low	149 Å²	149	142.6 Å²	142.6	90%	0.903	71%	0.714	S	S	*	*			trans	37.5	140.5	131.5	-69.5	0	0	0	0	130.1
188	G	36.1	Very low	45.9	Very low	81 Å²	81	139.2 Å²	139.2	84%	0.835	69%	0.691	S	S	*	*			trans	164.3	155.5	156.9	0	0	0	0	0	120.2
189	F	38.1	Very low	47.8	Very low	207 Å²	207	136.7 Å²	136.7	91%	0.908	68%	0.681	S	S	*	*			trans	-135.4	164.1	-166.5	-102.6	-89.8	0	0	0	118.8
190	F	36.8	Very low	49.8	Very low	208 Å²	208	137.3 Å²	137.3	91%	0.912	68%	0.677	S	S	*	*			trans	159.1	157.7	139.4	-91.7	-65.9	0	0	0	119.1
191	C	40	Very low	51.9	Low	127 Å²	127	133.1 Å²	133.1	86%	0.858	68%	0.676	S	S	*	*			trans	-156.2	175.3	-172.4	-70.1	0	0	0	0	119
192	E	38.3	Very low	53.8	Low	189 Å²	189	130.8 Å²	130.8	88%	0.883	67%	0.671	S	S	*	*			trans	-131.6	-159.6	173.2	-66.1	-165.4	158.8	0	0	116.7	N215	E192-N215 PolarHBondContact O-ND2 2.88Å
193	K	51.3	Low	55.8	Low	198 Å²	198	125.8 Å²	125.8	86%	0.861	65%	0.654	S	S	*	*			trans	-125.8	171.6	-148.5	-136.3	-173	-179.1	-171.9	0	121.6	N215	K193-N215 WeakPolarHBondContact CG-OD1 3.39Å
194	N	62.9	Low	58	Low	50 Å²	50	122.2 Å²	122.2	27%	0.267	65%	0.645	S	S	.	*			trans	-106.8	174	-155.3	-160.6	32.5	0	0	0	122.9	D213 T214 N215 T216	N194-D213 VanDerWaalsContact ND2-CG 3.28Å; N194-D213 PolarHBondContact ND2-OD1 2.79Å; N194-D213 PolarHBondContact ND2-OD2 2.77Å; N194-T214 VanDerWaalsContact CG-O 3.27Å; N194-T214 PolarHBondContact ND2-O 3.28Å; N194-T214 PolarHBondContact OD1-O 3.42Å; N194-N215 HydrophobicContact CB-CB 4.28Å; N194-N215 VanDerWaalsContact CB-O 3.29Å; N194-N215 WeakPolarHBondContact CB-O 3.34Å; N194-N215 PolarHBondContact OD1-O 3.39Å; N194-T216 WeakPolarHBondContact OD1-CA 3.03Å; N194-T216 PolarHBondContact OD1-N 2.8Å; N194-T216 VanDerWaalsContact OD1-N 3.07Å
195	I	67.3	Low	60	Low	116 Å²	116	117.9 Å²	117.9	60%	0.595	62%	0.617	S	S	*	*			trans	-121.5	139.2	159.2	-61.1	170.7	0	0	0	111.1
196	D	78.3	Confident	62	Low	61 Å²	61	113 Å²	113	33%	0.326	59%	0.594	S	S	.	*			trans	-92.6	108.8	179.1	175.3	-9.8	0	0	0	113.6	C198 A199 F200 D213	D196-C198 WeakPolarHBondContact OD1-CA 3.27Å; D196-C198 WeakPolarHBondContact OD1-CB 3.1Å; D196-C198 PolarHBondContact OD1-N 3.27Å; D196-A199 HydrophobicContact CB-CB 4.43Å; D196-A199 PolarHBondContact OD1-N 3.25Å; D196-A199 WeakPolarHBondContact OD2-CB 3.4Å; D196-F200 WeakPolarHBondContact O-CD2 3.28Å; D196-D213 HydrophobicContact CB-CB 4.35Å
197	E	81.2	Confident	63.7	Low	42 Å²	42	111.3 Å²	111.3	20%	0.196	60%	0.601	C	S	.	*	T	Hydrogen-bonded Turn	trans	-80.7	-19.4	177.4	-64.6	102.4	168.7	0	0	115.5	G201 L202 S217 Y218	E197-G201 PolarHBondContact O-N 3.32Å; E197-L202 HydrophobicContact CB-CB 3.94Å; E197-L202 HydrophobicContact CG-CB 4.19Å; E197-L202 PolarHBondContact O-N 3.17Å; E197-S217 VanDerWaalsContact OE2-CA 3.31Å; E197-S217 WeakPolarHBondContact OE2-CA 3.35Å; E197-Y218 HydrophobicContact CB-CD1 3.6Å; E197-Y218 HydrophobicContact CB-CE1 4.37Å; E197-Y218 HydrophobicContact CB-CG 4.24Å; E197-Y218 HydrophobicContact CG-CD1 3.99Å; E197-Y218 PolarHBondContact OE2-N 2.78Å
198	C	81.6	Confident	65.4	Low	30 Å²	30	108.5 Å²	108.5	20%	0.203	60%	0.602	C	S	.	*	T	Hydrogen-bonded Turn	trans	-71.1	-42.9	178.8	-65.3	0	0	0	0	110.5	D196 F200 G201 C211 R212	D196-C198 WeakPolarHBondContact OD1-CA 3.27Å; D196-C198 WeakPolarHBondContact OD1-CB 3.1Å; D196-C198 PolarHBondContact OD1-N 3.27Å; C198-F200 VanDerWaalsContact C-N 3.28Å; C198-F200 PolarHBondContact O-N 2.78Å; C198-G201 PolarHBondContact O-N 3.06Å; C198-C211 VanDerWaalsContact CA-SG 3.56Å; C198-C211 HydrophobicContact CB-CB 3.91Å; C198-C211 WeakPolarHBondContact CB-SG 3.38Å; C198-C211 WeakPolarHBondContact SG-CB 3.43Å; C198-C211 CovalentContact SG-SG 2.05Å; C198-C211 PolarHBondContact SG-SG 3.48Å; C198-R212 PolarHBondContact SG-N 2.97Å
199	A	77.9	Confident	67.2	Low	75 Å²	75	106.5 Å²	106.5	62%	0.62	57%	0.574	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64	-29.6	177.5	0	0	0	0	0	113.6	D196	D196-A199 HydrophobicContact CB-CB 4.43Å; D196-A199 PolarHBondContact OD1-N 3.25Å; D196-A199 WeakPolarHBondContact OD2-CB 3.4Å
200	F	75.9	Confident	69.2	Low	153 Å²	153	101.6 Å²	101.6	67%	0.671	55%	0.554	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.6	-0.5	178	-68.7	-61.3	0	0	0	114.5	D196 C198 L202	D196-F200 WeakPolarHBondContact O-CD2 3.28Å; C198-F200 VanDerWaalsContact C-N 3.28Å; C198-F200 PolarHBondContact O-N 2.78Å; F200-L202 VanDerWaalsContact C-N 3.25Å; F200-L202 HydrophobicContact CB-CD1 3.82Å; F200-L202 HydrophobicContact CB-CG 3.84Å; F200-L202 PolarHBondContact O-N 3.21Å
201	G	74.2	Confident	71.5	Confident	52 Å²	52	93.1 Å²	93.1	54%	0.536	52%	0.52	S	S	.	.	T	Hydrogen-bonded Turn	trans	65.6	27.7	-177.2	0	0	0	0	0	113.6	E197 C198 H203	E197-G201 PolarHBondContact O-N 3.32Å; C198-G201 PolarHBondContact O-N 3.06Å; G201-H203 VanDerWaalsContact C-N 3.3Å
202	L	76.7	Confident	73.4	Confident	110 Å²	110	92.2 Å²	92.2	58%	0.576	50%	0.499	S	S	*	.			trans	-88.4	0.4	-179.6	-63.8	172.9	0	0	0	112.7	E197 F200	E197-L202 HydrophobicContact CB-CB 3.94Å; E197-L202 HydrophobicContact CG-CB 4.19Å; E197-L202 PolarHBondContact O-N 3.17Å; F200-L202 VanDerWaalsContact C-N 3.25Å; F200-L202 HydrophobicContact CB-CD1 3.82Å; F200-L202 HydrophobicContact CB-CG 3.84Å; F200-L202 PolarHBondContact O-N 3.21Å
203	H	77.2	Confident	75.3	Confident	71 Å²	71	86.2 Å²	86.2	33%	0.329	47%	0.473	S	S	.	.			trans	-77.7	157.9	-179.3	67.7	86.6	0	0	0	113.9	G201 C211 Y218	G201-H203 VanDerWaalsContact C-N 3.3Å; H203-C211 WeakPolarHBondContact CB-SG 3.45Å; H203-C211 VanDerWaalsContact CD2-SG 3.6Å; H203-Y218 HydrophobicContact CB-CD1 4.39Å; H203-Y218 HydrophobicContact CB-CD2 3.59Å; H203-Y218 HydrophobicContact CB-CE1 4.41Å; H203-Y218 HydrophobicContact CB-CE2 3.63Å; H203-Y218 HydrophobicContact CB-CG 3.99Å
204	K	79.5	Confident	76.2	Confident	156 Å²	156	79.6 Å²	79.6	68%	0.678	45%	0.449	S	S	*	.			trans	-113.3	14.2	178.1	-66	-177.7	-179.7	175.5	0	114.7	Y218	K204-Y218 PolarHBondContact N-OH 2.7Å; K204-Y218 VanDerWaalsContact N-OH 3.15Å
205	C	79.6	Confident	76.2	Confident	18 Å²	18	81 Å²	81	12%	0.122	46%	0.457	C	S	.	.	P	Polyproline II helix	trans	-53.4	134.8	179.7	-54.4	0	0	0	0	113.3	T209 C220	C205-T209 WeakPolarHBondContact CB-OG1 3.39Å; C205-C220 WeakPolarHBondContact CA-SG 3.23Å; C205-C220 HydrophobicContact CB-CB 3.69Å; C205-C220 WeakPolarHBondContact CB-SG 3.34Å; C205-C220 WeakPolarHBondContact SG-CB 3.02Å; C205-C220 CovalentContact SG-SG 2.03Å; C205-C220 PolarHBondContact SG-SG 3.06Å
206	P	76.1	Confident	75.9	Confident	53 Å²	53	81.4 Å²	81.4	34%	0.344	46%	0.464	S	S	.	.	P	Polyproline II helix	trans	-55.9	149.8	174.4	-26.2	33.4	0	0	0	114	G208 T209 N230 C231	P206-G208 PolarHBondContact O-N 3.26Å; P206-G208 VanDerWaalsContact O-N 3.1Å; P206-T209 HydrophobicContact CB-CG2 4.25Å; P206-T209 WeakPolarHBondContact CD-OG1 3.34Å; P206-T209 HydrophobicContact CG-CG2 4.47Å; P206-T209 PolarHBondContact O-N 2.97Å; P206-T209 PolarHBondContact O-OG1 3.33Å; P206-N230 WeakPolarHBondContact CD-O 3.42Å; P206-N230 WeakPolarHBondContact CG-O 2.96Å; P206-C231 HydrophobicContact CG-CB 4.48Å
207	L	72.1	Confident	75.6	Confident	191 Å²	191	80.9 Å²	80.9	100%	1	47%	0.466	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.8	116.1	172.3	-77.2	165.3	0	0	0	110.7
208	G	73.5	Confident	75.6	Confident	90 Å²	90	80.6 Å²	80.6	93%	0.928	46%	0.463	S	S	*	.	T	Hydrogen-bonded Turn	trans	102.6	-2.7	-177.8	0	0	0	0	0	115.6	P206	P206-G208 PolarHBondContact O-N 3.26Å; P206-G208 VanDerWaalsContact O-N 3.1Å
209	T	73.6	Confident	75.5	Confident	40 Å²	40	84 Å²	84	25%	0.245	47%	0.472	C	S	.	.	P	Polyproline II helix	trans	-99.6	148.1	173.6	58.1	0	0	0	0	112.1	C205 P206 V221	C205-T209 WeakPolarHBondContact CB-OG1 3.39Å; P206-T209 HydrophobicContact CB-CG2 4.25Å; P206-T209 WeakPolarHBondContact CD-OG1 3.34Å; P206-T209 HydrophobicContact CG-CG2 4.47Å; P206-T209 PolarHBondContact O-N 2.97Å; P206-T209 PolarHBondContact O-OG1 3.33Å; T209-V221 WeakPolarHBondContact CB-O 3.07Å; T209-V221 WeakPolarHBondContact CG2-O 3.37Å
210	E	80.1	Confident	75.6	Confident	104 Å²	104	80.8 Å²	80.8	49%	0.486	45%	0.445	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	131.1	179.7	-175.2	-172.9	132	0	0	110.5	R212 C220 V221	E210-R212 IonicContact OE1-CZ 2.82Å; E210-R212 IonicContact OE1-NE 3.73Å; E210-R212 PolarHBondContact OE1-NE 2.85Å; E210-R212 IonicContact OE1-NH2 3.68Å; E210-R212 PolarHBondContact OE1-NH2 3.04Å; E210-R212 IonicContact OE2-NH2 2.61Å; E210-C220 CarbonylContact O-C 3.56Å; E210-C220 WeakPolarHBondContact O-CA 3.34Å; E210-V221 HydrophobicContact CB-CB 4Å; E210-V221 HydrophobicContact CB-CG2 3.93Å; E210-V221 HydrophobicContact CG-CG2 4.35Å; E210-V221 PolarHBondContact O-N 3.23Å
211	C	83.6	Confident	75.9	Confident	29 Å²	29	75.8 Å²	75.8	20%	0.196	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	138.1	173.2	-170.7	0	0	0	0	110.4	C198 H203	C198-C211 VanDerWaalsContact CA-SG 3.56Å; C198-C211 HydrophobicContact CB-CB 3.91Å; C198-C211 WeakPolarHBondContact CB-SG 3.38Å; C198-C211 WeakPolarHBondContact SG-CB 3.43Å; C198-C211 CovalentContact SG-SG 2.05Å; C198-C211 PolarHBondContact SG-SG 3.48Å; H203-C211 WeakPolarHBondContact CB-SG 3.45Å; H203-C211 VanDerWaalsContact CD2-SG 3.6Å
212	R	81.3	Confident	76	Confident	108 Å²	108	75 Å²	75	41%	0.408	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	129.4	173.2	-70.9	-174.9	175.3	178.3	5.4	112.2	C198 E210 Y218 Y219 V221	C198-R212 PolarHBondContact SG-N 2.97Å; E210-R212 IonicContact OE1-CZ 2.82Å; E210-R212 IonicContact OE1-NE 3.73Å; E210-R212 PolarHBondContact OE1-NE 2.85Å; E210-R212 IonicContact OE1-NH2 3.68Å; E210-R212 PolarHBondContact OE1-NH2 3.04Å; E210-R212 IonicContact OE2-NH2 2.61Å; R212-Y218 CarbonylContact O-C 3.22Å; R212-Y218 VanDerWaalsContact O-CA 3.24Å; R212-Y218 WeakPolarHBondContact O-CA 3.36Å; R212-Y219 HydrophobicContact CB-CD1 3.91Å; R212-Y219 HydrophobicContact CB-CE1 3.42Å; R212-Y219 VanDerWaalsContact CB-CE1 3.42Å; R212-Y219 HydrophobicContact CB-CE2 4.25Å; R212-Y219 WeakPolarHBondContact CD-OH 3.01Å; R212-Y219 HydrophobicContact CG-CE1 4.45Å; R212-Y219 PolarHBondContact N-O 2.99Å; R212-Y219 WeakPolarHBondContact O-CD1 3.18Å; R212-Y219 PolarHBondContact O-N 2.92Å; R212-V221 HydrophobicContact CG-CG2 4.18Å
213	D	77.1	Confident	75.8	Confident	63 Å²	63	73.3 Å²	73.3	34%	0.337	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72	147.7	172.1	-179.2	43.6	0	0	0	111.8	N194 D196	N194-D213 VanDerWaalsContact ND2-CG 3.28Å; N194-D213 PolarHBondContact ND2-OD1 2.79Å; N194-D213 PolarHBondContact ND2-OD2 2.77Å; D196-D213 HydrophobicContact CB-CB 4.35Å
214	T	69.9	Low	75.6	Confident	59 Å²	59	77.8 Å²	77.8	36%	0.362	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	160.5	169	76.9	0	0	0	0	109.6	N194 T216 S217 Y219	N194-T214 VanDerWaalsContact CG-O 3.27Å; N194-T214 PolarHBondContact ND2-O 3.28Å; N194-T214 PolarHBondContact OD1-O 3.42Å; T214-T216 PolarHBondContact O-N 2.92Å; T214-S217 CarbonylContact C-O 3.51Å; T214-S217 WeakPolarHBondContact CA-O 3.43Å; T214-S217 WeakPolarHBondContact CB-O 3.02Å; T214-S217 PolarHBondContact N-O 3.36Å; T214-S217 PolarHBondContact O-N 3.04Å; T214-S217 VanDerWaalsContact O-O 3.07Å; T214-S217 PolarHBondContact OG1-O 3.18Å; T214-Y219 HydrophobicContact CG2-CD1 3.43Å; T214-Y219 VanDerWaalsContact CG2-CD1 3.43Å; T214-Y219 HydrophobicContact CG2-CE1 3.42Å; T214-Y219 VanDerWaalsContact CG2-CE1 3.42Å
215	N	62.7	Low	75.3	Confident	81 Å²	81	70.9 Å²	70.9	43%	0.433	42%	0.415	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.1	10.6	-159.6	-168.7	77.9	0	0	0	117.4	E192 K193 N194	E192-N215 PolarHBondContact O-ND2 2.88Å; K193-N215 WeakPolarHBondContact CG-OD1 3.39Å; N194-N215 HydrophobicContact CB-CB 4.28Å; N194-N215 VanDerWaalsContact CB-O 3.29Å; N194-N215 WeakPolarHBondContact CB-O 3.34Å; N194-N215 PolarHBondContact OD1-O 3.39Å
216	T	62.5	Low	75.3	Confident	123 Å²	123	75.7 Å²	75.7	76%	0.755	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	-147.9	7.3	160.5	56.9	0	0	0	0	114.7	N194 T214	N194-T216 WeakPolarHBondContact OD1-CA 3.03Å; N194-T216 PolarHBondContact OD1-N 2.8Å; N194-T216 VanDerWaalsContact OD1-N 3.07Å; T214-T216 PolarHBondContact O-N 2.92Å
217	S	71	Confident	75.2	Confident	51 Å²	51	76.2 Å²	76.2	36%	0.357	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	179.9	153.9	-172.7	-179.8	0	0	0	0	112.2	E197 T214	E197-S217 VanDerWaalsContact OE2-CA 3.31Å; E197-S217 WeakPolarHBondContact OE2-CA 3.35Å; T214-S217 CarbonylContact C-O 3.51Å; T214-S217 WeakPolarHBondContact CA-O 3.43Å; T214-S217 WeakPolarHBondContact CB-O 3.02Å; T214-S217 PolarHBondContact N-O 3.36Å; T214-S217 PolarHBondContact O-N 3.04Å; T214-S217 VanDerWaalsContact O-O 3.07Å; T214-S217 PolarHBondContact OG1-O 3.18Å
218	Y	81.3	Confident	75.2	Confident	35 Å²	35	68 Å²	68	14%	0.137	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	163.7	162.3	73.5	-79.7	0	0	0	114.2	E197 H203 K204 R212	E197-Y218 HydrophobicContact CB-CD1 3.6Å; E197-Y218 HydrophobicContact CB-CE1 4.37Å; E197-Y218 HydrophobicContact CB-CG 4.24Å; E197-Y218 HydrophobicContact CG-CD1 3.99Å; E197-Y218 PolarHBondContact OE2-N 2.78Å; H203-Y218 HydrophobicContact CB-CD1 4.39Å; H203-Y218 HydrophobicContact CB-CD2 3.59Å; H203-Y218 HydrophobicContact CB-CE1 4.41Å; H203-Y218 HydrophobicContact CB-CE2 3.63Å; H203-Y218 HydrophobicContact CB-CG 3.99Å; K204-Y218 PolarHBondContact N-OH 2.7Å; K204-Y218 VanDerWaalsContact N-OH 3.15Å; R212-Y218 CarbonylContact O-C 3.22Å; R212-Y218 VanDerWaalsContact O-CA 3.24Å; R212-Y218 WeakPolarHBondContact O-CA 3.36Å
219	Y	78.9	Confident	75	Confident	101 Å²	101	69.3 Å²	69.3	40%	0.396	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	172.8	158.3	71.5	-76.8	0	0	0	110.9	R212 T214 V221	R212-Y219 HydrophobicContact CB-CD1 3.91Å; R212-Y219 HydrophobicContact CB-CE1 3.42Å; R212-Y219 VanDerWaalsContact CB-CE1 3.42Å; R212-Y219 HydrophobicContact CB-CE2 4.25Å; R212-Y219 WeakPolarHBondContact CD-OH 3.01Å; R212-Y219 HydrophobicContact CG-CE1 4.45Å; R212-Y219 PolarHBondContact N-O 2.99Å; R212-Y219 WeakPolarHBondContact O-CD1 3.18Å; R212-Y219 PolarHBondContact O-N 2.92Å; T214-Y219 HydrophobicContact CG2-CD1 3.43Å; T214-Y219 VanDerWaalsContact CG2-CD1 3.43Å; T214-Y219 HydrophobicContact CG2-CE1 3.42Å; T214-Y219 VanDerWaalsContact CG2-CE1 3.42Å; Y219-V221 HydrophobicContact CE2-CG2 4.39Å
220	C	81.5	Confident	74.9	Confident	8 Å²	8	70.3 Å²	70.3	5%	0.054	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	137.3	-179.7	-49.8	0	0	0	0	109.9	C205 E210 C222 I229	C205-C220 WeakPolarHBondContact CA-SG 3.23Å; C205-C220 HydrophobicContact CB-CB 3.69Å; C205-C220 WeakPolarHBondContact CB-SG 3.34Å; C205-C220 WeakPolarHBondContact SG-CB 3.02Å; C205-C220 CovalentContact SG-SG 2.03Å; C205-C220 PolarHBondContact SG-SG 3.06Å; E210-C220 CarbonylContact O-C 3.56Å; E210-C220 WeakPolarHBondContact O-CA 3.34Å; C220-C222 PolarHBondContact O-N 3.11Å; C220-I229 PolarHBondContact SG-O 3.41Å
221	V	81	Confident	74.7	Confident	49 Å²	49	65.9 Å²	65.9	30%	0.297	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	113.7	176.5	-176.1	0	0	0	0	109	T209 E210 R212 Y219	T209-V221 WeakPolarHBondContact CB-O 3.07Å; T209-V221 WeakPolarHBondContact CG2-O 3.37Å; E210-V221 HydrophobicContact CB-CB 4Å; E210-V221 HydrophobicContact CB-CG2 3.93Å; E210-V221 HydrophobicContact CG-CG2 4.35Å; E210-V221 PolarHBondContact O-N 3.23Å; R212-V221 HydrophobicContact CG-CG2 4.18Å; Y219-V221 HydrophobicContact CE2-CG2 4.39Å
222	C	77.4	Confident	74.4	Confident	35 Å²	35	69.3 Å²	69.3	24%	0.236	38%	0.383	C	S	.	.	P	Polyproline II helix	trans	-84.9	156.9	179.1	-53.2	0	0	0	0	111.9	C220 R226 C231	C220-C222 PolarHBondContact O-N 3.11Å; C222-R226 HydrophobicContact CB-CB 4.36Å; C222-R226 WeakPolarHBondContact CB-O 3.39Å; C222-C231 WeakPolarHBondContact CA-SG 3.04Å; C222-C231 HydrophobicContact CB-CB 3.7Å; C222-C231 WeakPolarHBondContact CB-SG 3.3Å; C222-C231 WeakPolarHBondContact SG-CA 3.24Å; C222-C231 WeakPolarHBondContact SG-CB 3.29Å; C222-C231 CovalentContact SG-SG 2.04Å; C222-C231 PolarHBondContact SG-SG 3.4Å
223	A	72.3	Confident	74.3	Confident	74 Å²	74	69.4 Å²	69.4	61%	0.612	39%	0.388	S	S	*	.	P	Polyproline II helix	trans	-75.3	158	166.2	0	0	0	0	0	110.6	R226	A223-R226 PolarHBondContact O-N 3.24Å
224	D	73.5	Confident	74.6	Confident	166 Å²	166	69.6 Å²	69.6	89%	0.888	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.4	143.3	178.7	-56.2	-45.8	0	0	0	111.9	R226	D224-R226 VanDerWaalsContact C-N 3.33Å
225	G	72.7	Confident	75.1	Confident	11 Å²	11	67.8 Å²	67.8	11%	0.113	38%	0.377	C	S	.	.	T	Hydrogen-bonded Turn	trans	79.2	5.2	-173.7	0	0	0	0	0	115	V235	G225-V235 PolarHBondContact O-N 3.37Å; G225-V235 VanDerWaalsContact O-N 3.14Å
226	R	79.1	Confident	76.1	Confident	119 Å²	119	66 Å²	66	45%	0.449	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	148.9	177.9	-66.5	-166.1	175.4	-154.8	-3.3	115.6	C222 A223 D224 C231 E233	C222-R226 HydrophobicContact CB-CB 4.36Å; C222-R226 WeakPolarHBondContact CB-O 3.39Å; A223-R226 PolarHBondContact O-N 3.24Å; D224-R226 VanDerWaalsContact C-N 3.33Å; R226-C231 WeakPolarHBondContact CD-O 3.5Å; R226-E233 VanDerWaalsContact CA-O 3.32Å; R226-E233 WeakPolarHBondContact CA-O 3.27Å
227	T	73.9	Confident	77.3	Confident	63 Å²	63	61 Å²	61	39%	0.387	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	-172.5	-177.8	-166.7	0	0	0	0	112.1	C231 T232 E233 V235	T227-C231 CarbonylContact O-C 3.3Å; T227-C231 VanDerWaalsContact O-CA 3.31Å; T227-C231 WeakPolarHBondContact O-CA 3.34Å; T227-T232 PolarHBondContact O-N 2.03Å; T227-E233 HydrophobicContact CG2-CB 3.65Å; T227-E233 PolarHBondContact N-O 2.87Å; T227-E233 WeakPolarHBondContact O-CB 3.24Å; T227-E233 PolarHBondContact O-N 3.35Å; T227-V235 HydrophobicContact CG2-CG2 4.16Å
228	G	71.8	Confident	77.9	Confident	18 Å²	18	60.3 Å²	60.3	19%	0.186	33%	0.331	C	S	.	.	S	Bend	trans	81.8	157.2	-176.3	0	0	0	0	0	113.3	N230 C231 E233	G228-N230 PolarHBondContact O-N 2.03Å; G228-C231 PolarHBondContact O-N 2.83Å; G228-E233 WeakPolarHBondContact CA-OE2 3.25Å
229	I	70.5	Confident	78	Confident	118 Å²	118	66.8 Å²	66.8	61%	0.605	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.4	-29.9	-171.7	-64	162.9	0	0	0	112.9	C220	C220-I229 PolarHBondContact SG-O 3.41Å
230	N	70.4	Confident	78.1	Confident	62 Å²	62	68.1 Å²	68.1	33%	0.332	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.9	15	178.7	-57.7	-40.6	0	0	0	113.4	P206 G228 T232	P206-N230 WeakPolarHBondContact CD-O 3.42Å; P206-N230 WeakPolarHBondContact CG-O 2.96Å; G228-N230 PolarHBondContact O-N 2.03Å; N230-T232 HydrophobicContact CB-CG2 4.12Å; N230-T232 PolarHBondContact O-N 3.15Å
231	C	75.7	Confident	78	Confident	11 Å²	11	70.3 Å²	70.3	7%	0.074	39%	0.394	C	S	.	.	S	Bend	trans	55.4	36.9	-177.7	-51.7	0	0	0	0	114.2	P206 C222 R226 T227 G228	P206-C231 HydrophobicContact CG-CB 4.48Å; C222-C231 WeakPolarHBondContact CA-SG 3.04Å; C222-C231 HydrophobicContact CB-CB 3.7Å; C222-C231 WeakPolarHBondContact CB-SG 3.3Å; C222-C231 WeakPolarHBondContact SG-CA 3.24Å; C222-C231 WeakPolarHBondContact SG-CB 3.29Å; C222-C231 CovalentContact SG-SG 2.04Å; C222-C231 PolarHBondContact SG-SG 3.4Å; R226-C231 WeakPolarHBondContact CD-O 3.5Å; T227-C231 CarbonylContact O-C 3.3Å; T227-C231 VanDerWaalsContact O-CA 3.31Å; T227-C231 WeakPolarHBondContact O-CA 3.34Å; G228-C231 PolarHBondContact O-N 2.83Å
232	T	77.9	Confident	78	Confident	101 Å²	101	71.9 Å²	71.9	62%	0.62	40%	0.403	S	S	*	.			trans	-104.4	-12.3	-176.2	44.1	0	0	0	0	113.9	T227 N230	T227-T232 PolarHBondContact O-N 2.03Å; N230-T232 HydrophobicContact CB-CG2 4.12Å; N230-T232 PolarHBondContact O-N 3.15Å
233	E	78.9	Confident	78.1	Confident	109 Å²	109	75 Å²	75	51%	0.509	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	144.9	-177.4	-69.3	153.5	-146.6	0	0	110.2	R226 T227 G228	R226-E233 VanDerWaalsContact CA-O 3.32Å; R226-E233 WeakPolarHBondContact CA-O 3.27Å; T227-E233 HydrophobicContact CG2-CB 3.65Å; T227-E233 PolarHBondContact N-O 2.87Å; T227-E233 WeakPolarHBondContact O-CB 3.24Å; T227-E233 PolarHBondContact O-N 3.35Å; G228-E233 WeakPolarHBondContact CA-OE2 3.25Å
234	D	83.5	Confident	78.5	Confident	68 Å²	68	77.6 Å²	77.6	36%	0.364	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	139.2	178.5	-169.1	36.5	0	0	0	109.8	N253 N255 G256	D234-N253 PolarHBondContact OD2-ND2 2.94Å; D234-N255 WeakPolarHBondContact OD1-CA 3.24Å; D234-G256 PolarHBondContact OD1-N 3.25Å
235	V	80.4	Confident	78.9	Confident	20 Å²	20	70.4 Å²	70.4	12%	0.121	37%	0.373	C	S	.	.	P	Polyproline II helix	trans	-86.2	130	170.8	178.4	0	0	0	0	108.4	G225 T227 E237 N253	G225-V235 PolarHBondContact O-N 3.37Å; G225-V235 VanDerWaalsContact O-N 3.14Å; T227-V235 HydrophobicContact CG2-CG2 4.16Å; V235-E237 HydrophobicContact CG1-CG 4.13Å; V235-E237 PolarHBondContact O-N 2.67Å; V235-N253 PolarHBondContact O-ND2 2.73Å
236	D	85.1	Confident	79.2	Confident	43 Å²	43	71.1 Å²	71.1	23%	0.23	38%	0.376	C	S	.	.			trans	-94.4	82.1	174.7	-166.1	-41.8	0	0	0	109.6	C238 K239 E240 N253	D236-C238 PolarHBondContact O-N 3.15Å; D236-C238 VanDerWaalsContact O-N 3.16Å; D236-C238 PolarHBondContact OD1-N 2.97Å; D236-K239 HydrophobicContact CB-CB 4.11Å; D236-K239 HydrophobicContact CB-CD 4.49Å; D236-K239 HydrophobicContact CB-CG 4.32Å; D236-K239 PolarHBondContact O-N 2.89Å; D236-K239 PolarHBondContact OD1-N 2.82Å; D236-K239 IonicContact OD2-NZ 2.75Å; D236-K239 PolarHBondContact OD2-NZ 2.04Å; D236-E240 PolarHBondContact O-N 3.2Å; D236-N253 VanDerWaalsContact CA-OD1 3.29Å; D236-N253 WeakPolarHBondContact CA-OD1 3.28Å; D236-N253 PolarHBondContact OD1-OD1 3.22Å
237	E	85.8	Confident	79.2	Confident	20 Å²	20	74.4 Å²	74.4	9%	0.093	39%	0.394	C	S	.	.	H	α-helix	trans	-59.7	-30.7	-174.7	-59.6	110.9	155.5	0	0	111.4	V235 K239 E240 G241 T242 Y243 N253 Y258	V235-E237 HydrophobicContact CG1-CG 4.13Å; V235-E237 PolarHBondContact O-N 2.67Å; E237-K239 VanDerWaalsContact C-N 3.34Å; E237-K239 PolarHBondContact O-N 3.35Å; E237-E240 PolarHBondContact O-N 3.5Å; E237-G241 PolarHBondContact O-N 2.91Å; E237-T242 VanDerWaalsContact CA-OG1 3.3Å; E237-T242 WeakPolarHBondContact CA-OG1 3.21Å; E237-T242 WeakPolarHBondContact CB-OG1 3.02Å; E237-T242 PolarHBondContact O-N 2.97Å; E237-T242 VanDerWaalsContact O-N 3.16Å; E237-Y243 WeakPolarHBondContact O-CD1 3.04Å; E237-N253 PolarHBondContact N-OD1 2.97Å; E237-N253 PolarHBondContact OE2-OD1 3.1Å; E237-Y258 HydrophobicContact CB-CD1 3.78Å; E237-Y258 HydrophobicContact CB-CG 4.32Å; E237-Y258 HydrophobicContact CG-CD1 3.89Å; E237-Y258 PolarHBondContact OE2-N 2.84Å
238	C	85.2	Confident	79.3	Confident	36 Å²	36	76 Å²	76	24%	0.243	39%	0.394	C	S	.	.	H	α-helix	trans	-68.3	-26.9	175.3	-57.5	0	0	0	0	113.8	D236 C251 K252 N253	D236-C238 PolarHBondContact O-N 3.15Å; D236-C238 VanDerWaalsContact O-N 3.16Å; D236-C238 PolarHBondContact OD1-N 2.97Å; C238-C251 WeakPolarHBondContact CA-SG 3.47Å; C238-C251 HydrophobicContact CB-CB 3.81Å; C238-C251 WeakPolarHBondContact CB-SG 3.41Å; C238-C251 WeakPolarHBondContact SG-CB 3.34Å; C238-C251 CovalentContact SG-SG 2.04Å; C238-C251 PolarHBondContact SG-SG 2.82Å; C238-K252 PolarHBondContact SG-N 3.06Å; C238-N253 PolarHBondContact SG-N 3.32Å
239	K	83.8	Confident	79.7	Confident	170 Å²	170	76 Å²	76	74%	0.739	39%	0.391	S	S	*	.	H	α-helix	trans	-87.1	-36.1	170.5	-73.9	-167.5	-169	83.1	0	113.2	D236 E237 G241	D236-K239 HydrophobicContact CB-CB 4.11Å; D236-K239 HydrophobicContact CB-CD 4.49Å; D236-K239 HydrophobicContact CB-CG 4.32Å; D236-K239 PolarHBondContact O-N 2.89Å; D236-K239 PolarHBondContact OD1-N 2.82Å; D236-K239 IonicContact OD2-NZ 2.75Å; D236-K239 PolarHBondContact OD2-NZ 2.04Å; E237-K239 VanDerWaalsContact C-N 3.34Å; E237-K239 PolarHBondContact O-N 3.35Å; K239-G241 VanDerWaalsContact C-N 3.32Å
240	E	80.5	Confident	80.4	Confident	129 Å²	129	73.9 Å²	73.9	60%	0.603	38%	0.383	S	S	*	.	H	α-helix	trans	-77.1	-19.6	179.9	-66.7	-167.7	175.5	0	0	113	D236 E237 T242	D236-E240 PolarHBondContact O-N 3.2Å; E237-E240 PolarHBondContact O-N 3.5Å; E240-T242 HydrophobicContact CB-CG2 4.16Å
241	G	79.3	Confident	81.2	Confident	55 Å²	55	72.1 Å²	72.1	57%	0.567	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.6	22.7	-179.1	0	0	0	0	0	113.5	E237 K239	E237-G241 PolarHBondContact O-N 2.91Å; K239-G241 VanDerWaalsContact C-N 3.32Å
242	T	80	Confident	81.7	Confident	81 Å²	81	76.9 Å²	76.9	50%	0.497	40%	0.395	S	S	.	.			trans	-95	10.4	-174.8	46.3	0	0	0	0	113.6	E237 E240	E237-T242 VanDerWaalsContact CA-OG1 3.3Å; E237-T242 WeakPolarHBondContact CA-OG1 3.21Å; E237-T242 WeakPolarHBondContact CB-OG1 3.02Å; E237-T242 PolarHBondContact O-N 2.97Å; E237-T242 VanDerWaalsContact O-N 3.16Å; E240-T242 HydrophobicContact CB-CG2 4.16Å
243	Y	79.9	Confident	82	Confident	101 Å²	101	74.1 Å²	74.1	40%	0.396	38%	0.377	S	S	.	.			trans	-85.6	142	-178.1	61.7	-94.5	0	0	0	113.6	E237 C245 C251	E237-Y243 WeakPolarHBondContact O-CD1 3.04Å; Y243-C245 VanDerWaalsContact C-N 3.31Å; Y243-C245 HydrophobicContact CD2-CB 3.6Å; Y243-C245 HydrophobicContact CE2-CB 4.1Å; Y243-C245 PolarHBondContact O-N 3.09Å; Y243-C251 HydrophobicContact CD1-CB 4.1Å; Y243-C251 VanDerWaalsContact CD1-SG 3.58Å; Y243-C251 HydrophobicContact CD2-CB 4.2Å; Y243-C251 HydrophobicContact CE1-CB 4.19Å; Y243-C251 HydrophobicContact CE2-CB 4.29Å; Y243-C251 HydrophobicContact CG-CB 4.1Å; Y243-C251 VanDerWaalsContact CG-SG 3.56Å
244	E	81.8	Confident	82.1	Confident	128 Å²	128	72.4 Å²	72.4	60%	0.598	37%	0.374	S	S	*	.			trans	-89.6	17.8	179	-55.5	179.5	129.8	0	0	113.7	Y258 Y270	E244-Y258 WeakPolarHBondContact CB-OH 3.4Å; E244-Y258 WeakPolarHBondContact CG-OH 3.44Å; E244-Y258 PolarHBondContact N-OH 3.15Å; E244-Y270 HydrophobicContact CB-CD1 3.92Å; E244-Y270 HydrophobicContact CB-CE1 3.67Å; E244-Y270 HydrophobicContact CG-CE1 4.47Å; E244-Y270 WeakPolarHBondContact O-CD1 3.04Å; E244-Y270 WeakPolarHBondContact OE2-CE1 3.11Å; E244-Y270 VanDerWaalsContact OE2-CZ 3.27Å; E244-Y270 PolarHBondContact OE2-OH 3.37Å
245	C	81.6	Confident	82	Confident	15 Å²	15	75.3 Å²	75.3	10%	0.101	39%	0.389	C	S	.	.			trans	-71.9	136.9	-178.1	-56.3	0	0	0	0	112.5	Y243 S249 C260	Y243-C245 VanDerWaalsContact C-N 3.31Å; Y243-C245 HydrophobicContact CD2-CB 3.6Å; Y243-C245 HydrophobicContact CE2-CB 4.1Å; Y243-C245 PolarHBondContact O-N 3.09Å; C245-S249 VanDerWaalsContact CB-OG 3.3Å; C245-S249 WeakPolarHBondContact CB-OG 3.1Å; C245-C260 WeakPolarHBondContact CA-SG 3.19Å; C245-C260 HydrophobicContact CB-CB 3.74Å; C245-C260 WeakPolarHBondContact CB-SG 2.88Å; C245-C260 VanDerWaalsContact SG-CA 3.57Å; C245-C260 WeakPolarHBondContact SG-CB 3Å; C245-C260 CovalentContact SG-SG 2.04Å; C245-C260 PolarHBondContact SG-SG 3.33Å
246	S	78.4	Confident	81.8	Confident	27 Å²	27	75.7 Å²	75.7	19%	0.189	40%	0.397	C	S	.	.			trans	-55.9	149.6	172.9	173.5	0	0	0	0	112.5	Y248 S249 Y270 C271	S246-Y248 PolarHBondContact O-N 2.7Å; S246-Y248 PolarHBondContact OG-N 2.9Å; S246-S249 PolarHBondContact O-N 2.72Å; S246-S249 PolarHBondContact O-OG 3.39Å; S246-Y270 WeakPolarHBondContact CB-O 3.42Å; S246-Y270 PolarHBondContact N-O 3.28Å; S246-C271 WeakPolarHBondContact CB-O 3.37Å; S246-C271 PolarHBondContact OG-O 3Å
247	F	78.6	Confident	81.6	Confident	188 Å²	188	76.4 Å²	76.4	83%	0.825	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.4	-29.5	173	-175.6	-97.5	0	0	0	112.6	S249	F247-S249 PolarHBondContact O-N 2.75Å; F247-S249 VanDerWaalsContact O-N 3.12Å
248	Y	76.1	Confident	81.6	Confident	96 Å²	96	77.7 Å²	77.7	38%	0.376	41%	0.41	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.2	37.1	175.9	-53.8	-71.5	0	0	0	113.4	S246 H263 Y266	S246-Y248 PolarHBondContact O-N 2.7Å; S246-Y248 PolarHBondContact OG-N 2.9Å; Y248-H263 WeakPolarHBondContact O-CB 2.92Å; Y248-H263 PolarHBondContact O-N 3.38Å; Y248-H263 PolarHBondContact O-ND1 3.06Å; Y248-H263 VanDerWaalsContact O-ND1 3.11Å; Y248-Y266 VanDerWaalsContact CB-CD2 3.47Å; Y248-Y266 HydrophobicContact CD1-CD2 4.28Å; Y248-Y266 AromaticContact CD1-CE2 3.61Å; Y248-Y266 HydrophobicContact CD1-CE2 3.61Å; Y248-Y266 AromaticContact CD1-CZ 3.92Å; Y248-Y266 HydrophobicContact CD2-CD1 4.13Å; Y248-Y266 HydrophobicContact CD2-CD2 4.35Å; Y248-Y266 AromaticContact CD2-CE1 3.57Å; Y248-Y266 HydrophobicContact CD2-CE1 3.57Å; Y248-Y266 AromaticContact CD2-CE2 3.83Å; Y248-Y266 HydrophobicContact CD2-CE2 3.83Å; Y248-Y266 HydrophobicContact CD2-CG 4.49Å; Y248-Y266 AromaticContact CD2-CZ 3.41Å; Y248-Y266 VanDerWaalsContact CD2-CZ 3.41Å; Y248-Y266 HydrophobicContact CE1-CE2 4.16Å; Y248-Y266 HydrophobicContact CE2-CE1 4.02Å; Y248-Y266 HydrophobicContact CE2-CE2 4.36Å; Y248-Y266 AromaticContact CE2-CZ 3.68Å; Y248-Y266 WeakPolarHBondContact CE2-OH 3.33Å; Y248-Y266 HydrophobicContact CG-CD1 4.35Å; Y248-Y266 AromaticContact CG-CD2 3.8Å; Y248-Y266 HydrophobicContact CG-CD2 3.8Å; Y248-Y266 HydrophobicContact CG-CE1 4.01Å; Y248-Y266 AromaticContact CG-CE2 3.41Å; Y248-Y266 HydrophobicContact CG-CE2 3.41Å; Y248-Y266 VanDerWaalsContact CG-CE2 3.41Å; Y248-Y266 HydrophobicContact CG-CG 4.26Å; Y248-Y266 AromaticContact CG-CZ 3.53Å
249	S	80.7	Confident	81.6	Confident	17 Å²	17	81.4 Å²	81.4	12%	0.119	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.8	168	178.8	70.5	0	0	0	0	114.1	C245 S246 F247 D261 H263 C271	C245-S249 VanDerWaalsContact CB-OG 3.3Å; C245-S249 WeakPolarHBondContact CB-OG 3.1Å; S246-S249 PolarHBondContact O-N 2.72Å; S246-S249 PolarHBondContact O-OG 3.39Å; F247-S249 PolarHBondContact O-N 2.75Å; F247-S249 VanDerWaalsContact O-N 3.12Å; S249-D261 CarbonylContact C-O 3.29Å; S249-D261 VanDerWaalsContact CA-O 3.24Å; S249-D261 WeakPolarHBondContact CA-O 3.29Å; S249-D261 VanDerWaalsContact CB-O 3.32Å; S249-D261 WeakPolarHBondContact CB-O 3.12Å; S249-H263 VanDerWaalsContact CA-ND1 3.33Å; S249-H263 WeakPolarHBondContact CA-ND1 3.42Å; S249-H263 PolarHBondContact N-ND1 3.33Å; S249-H263 VanDerWaalsContact N-ND1 3.15Å; S249-C271 WeakPolarHBondContact CB-SG 3.35Å
250	T	85.3	Confident	81.8	Confident	74 Å²	74	73.9 Å²	73.9	45%	0.454	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	124.7	177	-54.4	0	0	0	0	109.9	D261	T250-D261 PolarHBondContact N-O 2.9Å; T250-D261 PolarHBondContact O-N 2.81Å
251	C	86.8	Confident	82	Confident	26 Å²	26	69.8 Å²	69.8	18%	0.176	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73	138.7	175	-169.1	0	0	0	0	111.3	C238 Y243 K259	C238-C251 WeakPolarHBondContact CA-SG 3.47Å; C238-C251 HydrophobicContact CB-CB 3.81Å; C238-C251 WeakPolarHBondContact CB-SG 3.41Å; C238-C251 WeakPolarHBondContact SG-CB 3.34Å; C238-C251 CovalentContact SG-SG 2.04Å; C238-C251 PolarHBondContact SG-SG 2.82Å; Y243-C251 HydrophobicContact CD1-CB 4.1Å; Y243-C251 VanDerWaalsContact CD1-SG 3.58Å; Y243-C251 HydrophobicContact CD2-CB 4.2Å; Y243-C251 HydrophobicContact CE1-CB 4.19Å; Y243-C251 HydrophobicContact CE2-CB 4.29Å; Y243-C251 HydrophobicContact CG-CB 4.1Å; Y243-C251 VanDerWaalsContact CG-SG 3.56Å; C251-K259 CarbonylContact C-O 3.54Å
252	K	86.5	Confident	82.1	Confident	110 Å²	110	69.8 Å²	69.8	48%	0.478	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	122.3	170.2	-72.6	-179	174.8	170.7	0	110.5	C238 Y258 K259 D261	C238-K252 PolarHBondContact SG-N 3.06Å; K252-Y258 CarbonylContact O-C 3.48Å; K252-Y258 WeakPolarHBondContact O-CA 3.49Å; K252-K259 PolarHBondContact N-O 2.85Å; K252-K259 PolarHBondContact O-N 3.43Å; K252-D261 WeakPolarHBondContact CD-OD2 3.31Å; K252-D261 WeakPolarHBondContact CE-OD2 2.89Å; K252-D261 IonicContact NZ-OD2 3.46Å; K252-D261 PolarHBondContact NZ-OD2 3.21Å
253	N	82.9	Confident	82.2	Confident	43 Å²	43	70.7 Å²	70.7	23%	0.23	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	148.2	177.8	-139	70.3	0	0	0	111.8	D234 V235 D236 E237 C238	D234-N253 PolarHBondContact OD2-ND2 2.94Å; V235-N253 PolarHBondContact O-ND2 2.73Å; D236-N253 VanDerWaalsContact CA-OD1 3.29Å; D236-N253 WeakPolarHBondContact CA-OD1 3.28Å; D236-N253 PolarHBondContact OD1-OD1 3.22Å; E237-N253 PolarHBondContact N-OD1 2.97Å; E237-N253 PolarHBondContact OE2-OD1 3.1Å; C238-N253 PolarHBondContact SG-N 3.32Å
254	T	82.5	Confident	81.8	Confident	73 Å²	73	71.9 Å²	71.9	45%	0.448	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	159.1	170.7	71.5	0	0	0	0	108.8	G256 S257	T254-G256 PolarHBondContact O-N 3.37Å; T254-S257 CarbonylContact C-O 3.6Å; T254-S257 VanDerWaalsContact C-O 3.29Å; T254-S257 VanDerWaalsContact CA-O 3.24Å; T254-S257 WeakPolarHBondContact CA-O 3.37Å; T254-S257 WeakPolarHBondContact CB-O 3.39Å; T254-S257 PolarHBondContact N-O 2.98Å; T254-S257 PolarHBondContact O-N 2.81Å; T254-S257 PolarHBondContact OG1-O 2.71Å
255	N	81.7	Confident	81	Confident	129 Å²	129	66 Å²	66	69%	0.69	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.1	103.2	-173.6	-177.7	-4.6	0	0	0	111.1	D234	D234-N255 WeakPolarHBondContact OD1-CA 3.24Å
256	G	75.4	Confident	80.5	Confident	28 Å²	28	66.7 Å²	66.7	29%	0.289	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	89.7	11.3	-175.4	0	0	0	0	0	116.4	D234 T254	D234-G256 PolarHBondContact OD1-N 3.25Å; T254-G256 PolarHBondContact O-N 3.37Å
257	S	80.9	Confident	80.2	Confident	59 Å²	59	68.5 Å²	68.5	41%	0.413	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-175.8	172.3	173	-146.7	0	0	0	0	113.6	T254	T254-S257 CarbonylContact C-O 3.6Å; T254-S257 VanDerWaalsContact C-O 3.29Å; T254-S257 VanDerWaalsContact CA-O 3.24Å; T254-S257 WeakPolarHBondContact CA-O 3.37Å; T254-S257 WeakPolarHBondContact CB-O 3.39Å; T254-S257 PolarHBondContact N-O 2.98Å; T254-S257 PolarHBondContact O-N 2.81Å; T254-S257 PolarHBondContact OG1-O 2.71Å
258	Y	86.1	Confident	79.9	Confident	46 Å²	46	60.7 Å²	60.7	18%	0.18	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	164.1	173.3	64.2	-84.3	0	0	0	113.6	E237 E244 K252	E237-Y258 HydrophobicContact CB-CD1 3.78Å; E237-Y258 HydrophobicContact CB-CG 4.32Å; E237-Y258 HydrophobicContact CG-CD1 3.89Å; E237-Y258 PolarHBondContact OE2-N 2.84Å; E244-Y258 WeakPolarHBondContact CB-OH 3.4Å; E244-Y258 WeakPolarHBondContact CG-OH 3.44Å; E244-Y258 PolarHBondContact N-OH 3.15Å; K252-Y258 CarbonylContact O-C 3.48Å; K252-Y258 WeakPolarHBondContact O-CA 3.49Å
259	K	85.8	Confident	79.9	Confident	114 Å²	114	63.7 Å²	63.7	50%	0.496	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	135.9	173.4	-167.6	-151.5	174.4	-158.3	0	110.8	C251 K252 D261	C251-K259 CarbonylContact C-O 3.54Å; K252-K259 PolarHBondContact N-O 2.85Å; K252-K259 PolarHBondContact O-N 3.43Å; K259-D261 WeakPolarHBondContact CE-OD1 3.43Å; K259-D261 IonicContact NZ-OD1 3.72Å; K259-D261 PolarHBondContact NZ-OD1 3.25Å
260	C	86.9	Confident	79.9	Confident	13 Å²	13	66.1 Å²	66.1	9%	0.088	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	127.9	169.5	-41	0	0	0	0	110.4	C245	C245-C260 WeakPolarHBondContact CA-SG 3.19Å; C245-C260 HydrophobicContact CB-CB 3.74Å; C245-C260 WeakPolarHBondContact CB-SG 2.88Å; C245-C260 VanDerWaalsContact SG-CA 3.57Å; C245-C260 WeakPolarHBondContact SG-CB 3Å; C245-C260 CovalentContact SG-SG 2.04Å; C245-C260 PolarHBondContact SG-SG 3.33Å
261	D	84.7	Confident	79.6	Confident	43 Å²	43	62.6 Å²	62.6	23%	0.23	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	115.9	166.1	-85.1	-7.9	0	0	0	109.4	S249 T250 K252 K259	S249-D261 CarbonylContact C-O 3.29Å; S249-D261 VanDerWaalsContact CA-O 3.24Å; S249-D261 WeakPolarHBondContact CA-O 3.29Å; S249-D261 VanDerWaalsContact CB-O 3.32Å; S249-D261 WeakPolarHBondContact CB-O 3.12Å; T250-D261 PolarHBondContact N-O 2.9Å; T250-D261 PolarHBondContact O-N 2.81Å; K252-D261 WeakPolarHBondContact CD-OD2 3.31Å; K252-D261 WeakPolarHBondContact CE-OD2 2.89Å; K252-D261 IonicContact NZ-OD2 3.46Å; K252-D261 PolarHBondContact NZ-OD2 3.21Å; K259-D261 WeakPolarHBondContact CE-OD1 3.43Å; K259-D261 IonicContact NZ-OD1 3.72Å; K259-D261 PolarHBondContact NZ-OD1 3.25Å
262	C	81.7	Confident	78.9	Confident	54 Å²	54	65.7 Å²	65.7	37%	0.365	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	144.6	-173	-48.9	0	0	0	0	113.3	Y266 C271	C262-Y266 WeakPolarHBondContact CB-O 3.25Å; C262-C271 WeakPolarHBondContact CA-SG 3.33Å; C262-C271 HydrophobicContact CB-CB 3.66Å; C262-C271 WeakPolarHBondContact CB-SG 3.46Å; C262-C271 PolarHBondContact N-SG 3.48Å; C262-C271 VanDerWaalsContact N-SG 3.4Å; C262-C271 VanDerWaalsContact SG-CA 3.54Å; C262-C271 WeakPolarHBondContact SG-CB 3.48Å; C262-C271 CovalentContact SG-SG 2.03Å; C262-C271 PolarHBondContact SG-SG 2.6Å
263	H	81.4	Confident	78.1	Confident	101 Å²	101	65.9 Å²	65.9	47%	0.468	36%	0.363	S	S	.	.	P	Polyproline II helix	trans	-73.6	156.2	166.1	-70.9	80.3	0	0	0	110.7	Y248 S249 G265 Y266	Y248-H263 WeakPolarHBondContact O-CB 2.92Å; Y248-H263 PolarHBondContact O-N 3.38Å; Y248-H263 PolarHBondContact O-ND1 3.06Å; Y248-H263 VanDerWaalsContact O-ND1 3.11Å; S249-H263 VanDerWaalsContact CA-ND1 3.33Å; S249-H263 WeakPolarHBondContact CA-ND1 3.42Å; S249-H263 PolarHBondContact N-ND1 3.33Å; S249-H263 VanDerWaalsContact N-ND1 3.15Å; H263-G265 PolarHBondContact O-N 3.02Å; H263-Y266 PolarHBondContact O-N 3.36Å; H263-Y266 VanDerWaalsContact O-N 3.14Å
264	S	72.2	Confident	77.3	Confident	126 Å²	126	67.8 Å²	67.8	88%	0.881	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.3	128.5	175.7	-55.7	0	0	0	0	111.6
265	G	65.5	Low	76.4	Confident	4 Å²	4	66.9 Å²	66.9	4%	0.041	37%	0.365	C	S	.	.	T	Hydrogen-bonded Turn	trans	108.1	-20.9	-174.8	0	0	0	0	0	113.9	H263 L274 I275	H263-G265 PolarHBondContact O-N 3.02Å; G265-L274 WeakPolarHBondContact O-CA 3.26Å; G265-I275 WeakPolarHBondContact O-CG1 3.27Å; G265-I275 PolarHBondContact O-N 3.44Å
266	Y	70.5	Confident	75.7	Confident	29 Å²	29	63.8 Å²	63.8	11%	0.114	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	151.2	-174.4	-64.8	-90.6	0	0	0	114.1	Y248 C262 H263 E273 L274	Y248-Y266 VanDerWaalsContact CB-CD2 3.47Å; Y248-Y266 HydrophobicContact CD1-CD2 4.28Å; Y248-Y266 AromaticContact CD1-CE2 3.61Å; Y248-Y266 HydrophobicContact CD1-CE2 3.61Å; Y248-Y266 AromaticContact CD1-CZ 3.92Å; Y248-Y266 HydrophobicContact CD2-CD1 4.13Å; Y248-Y266 HydrophobicContact CD2-CD2 4.35Å; Y248-Y266 AromaticContact CD2-CE1 3.57Å; Y248-Y266 HydrophobicContact CD2-CE1 3.57Å; Y248-Y266 AromaticContact CD2-CE2 3.83Å; Y248-Y266 HydrophobicContact CD2-CE2 3.83Å; Y248-Y266 HydrophobicContact CD2-CG 4.49Å; Y248-Y266 AromaticContact CD2-CZ 3.41Å; Y248-Y266 VanDerWaalsContact CD2-CZ 3.41Å; Y248-Y266 HydrophobicContact CE1-CE2 4.16Å; Y248-Y266 HydrophobicContact CE2-CE1 4.02Å; Y248-Y266 HydrophobicContact CE2-CE2 4.36Å; Y248-Y266 AromaticContact CE2-CZ 3.68Å; Y248-Y266 WeakPolarHBondContact CE2-OH 3.33Å; Y248-Y266 HydrophobicContact CG-CD1 4.35Å; Y248-Y266 AromaticContact CG-CD2 3.8Å; Y248-Y266 HydrophobicContact CG-CD2 3.8Å; Y248-Y266 HydrophobicContact CG-CE1 4.01Å; Y248-Y266 AromaticContact CG-CE2 3.41Å; Y248-Y266 HydrophobicContact CG-CE2 3.41Å; Y248-Y266 VanDerWaalsContact CG-CE2 3.41Å; Y248-Y266 HydrophobicContact CG-CG 4.26Å; Y248-Y266 AromaticContact CG-CZ 3.53Å; C262-Y266 WeakPolarHBondContact CB-O 3.25Å; H263-Y266 PolarHBondContact O-N 3.36Å; H263-Y266 VanDerWaalsContact O-N 3.14Å; Y266-E273 CarbonylContact C-O 3.53Å; Y266-E273 VanDerWaalsContact CA-O 3.26Å; Y266-E273 WeakPolarHBondContact CA-O 3.07Å; Y266-L274 HydrophobicContact CD1-CD1 4.23Å; Y266-L274 HydrophobicContact CD1-CG 4.27Å; Y266-L274 HydrophobicContact CE1-CD1 3.67Å; Y266-L274 HydrophobicContact CE1-CG 3.88Å
267	T	72	Confident	75.4	Confident	66 Å²	66	64.8 Å²	64.8	41%	0.405	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	-178.4	-179	-169.2	0	0	0	0	111.6	C271 T272 E273	T267-C271 CarbonylContact O-C 3.49Å; T267-C271 VanDerWaalsContact O-CA 3.27Å; T267-C271 WeakPolarHBondContact O-CA 3.38Å; T267-T272 PolarHBondContact O-N 3.28Å; T267-T272 VanDerWaalsContact O-N 3.15Å; T267-E273 HydrophobicContact CG2-CB 3.63Å; T267-E273 PolarHBondContact N-O 3.05Å; T267-E273 PolarHBondContact O-N 3.45Å; T267-E273 VanDerWaalsContact O-N 3.08Å
268	G	72.4	Confident	75.2	Confident	24 Å²	24	62.9 Å²	62.9	25%	0.247	33%	0.33	C	S	.	.	T	Hydrogen-bonded Turn	trans	85.3	162.7	-174.6	0	0	0	0	0	113.5	Y270 C271	G268-Y270 PolarHBondContact O-N 2.04Å; G268-Y270 VanDerWaalsContact O-N 3.09Å; G268-C271 PolarHBondContact O-N 2.87Å
269	K	76.6	Confident	74.6	Confident	158 Å²	158	66 Å²	66	69%	0.687	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52	-37.4	-174.1	-178	-169.7	168.5	-155.2	0	113.4
270	Y	80.2	Confident	73.8	Confident	68 Å²	68	65.5 Å²	65.5	27%	0.267	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.9	7.3	-176.3	-60.8	-76.2	0	0	0	113.2	E244 S246 G268	E244-Y270 HydrophobicContact CB-CD1 3.92Å; E244-Y270 HydrophobicContact CB-CE1 3.67Å; E244-Y270 HydrophobicContact CG-CE1 4.47Å; E244-Y270 WeakPolarHBondContact O-CD1 3.04Å; E244-Y270 WeakPolarHBondContact OE2-CE1 3.11Å; E244-Y270 VanDerWaalsContact OE2-CZ 3.27Å; E244-Y270 PolarHBondContact OE2-OH 3.37Å; S246-Y270 WeakPolarHBondContact CB-O 3.42Å; S246-Y270 PolarHBondContact N-O 3.28Å; G268-Y270 PolarHBondContact O-N 2.04Å; G268-Y270 VanDerWaalsContact O-N 3.09Å
271	C	78.2	Confident	73.1	Confident	0 Å²	0	71.9 Å²	71.9	0%	0	38%	0.379	C	S	.	.	T	Hydrogen-bonded Turn	trans	60	44.1	-177.5	-49.1	0	0	0	0	113.6	S246 S249 C262 T267 G268	S246-C271 WeakPolarHBondContact CB-O 3.37Å; S246-C271 PolarHBondContact OG-O 3Å; S249-C271 WeakPolarHBondContact CB-SG 3.35Å; C262-C271 WeakPolarHBondContact CA-SG 3.33Å; C262-C271 HydrophobicContact CB-CB 3.66Å; C262-C271 WeakPolarHBondContact CB-SG 3.46Å; C262-C271 PolarHBondContact N-SG 3.48Å; C262-C271 VanDerWaalsContact N-SG 3.4Å; C262-C271 VanDerWaalsContact SG-CA 3.54Å; C262-C271 WeakPolarHBondContact SG-CB 3.48Å; C262-C271 CovalentContact SG-SG 2.03Å; C262-C271 PolarHBondContact SG-SG 2.6Å; T267-C271 CarbonylContact O-C 3.49Å; T267-C271 VanDerWaalsContact O-CA 3.27Å; T267-C271 WeakPolarHBondContact O-CA 3.38Å; G268-C271 PolarHBondContact O-N 2.87Å
272	T	73.4	Confident	72.9	Confident	92 Å²	92	75.1 Å²	75.1	56%	0.564	40%	0.4	S	S	*	.			trans	-108.9	-12.8	-173.9	48	0	0	0	0	114	T267	T267-T272 PolarHBondContact O-N 3.28Å; T267-T272 VanDerWaalsContact O-N 3.15Å
273	E	69	Low	73	Confident	113 Å²	113	73 Å²	73	53%	0.528	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	143.8	179.6	-66.1	162.6	-167.9	0	0	109.4	Y266 T267	Y266-E273 CarbonylContact C-O 3.53Å; Y266-E273 VanDerWaalsContact CA-O 3.26Å; Y266-E273 WeakPolarHBondContact CA-O 3.07Å; T267-E273 HydrophobicContact CG2-CB 3.63Å; T267-E273 PolarHBondContact N-O 3.05Å; T267-E273 PolarHBondContact O-N 3.45Å; T267-E273 VanDerWaalsContact O-N 3.08Å
274	L	66	Low	73.3	Confident	83 Å²	83	69.2 Å²	69.2	44%	0.435	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	153.4	172.9	-83.3	86.7	0	0	0	111.8	G265 Y266 D276 E294	G265-L274 WeakPolarHBondContact O-CA 3.26Å; Y266-L274 HydrophobicContact CD1-CD1 4.23Å; Y266-L274 HydrophobicContact CD1-CG 4.27Å; Y266-L274 HydrophobicContact CE1-CD1 3.67Å; Y266-L274 HydrophobicContact CE1-CG 3.88Å; L274-D276 PolarHBondContact O-N 3.03Å; L274-E294 HydrophobicContact CD2-CB 4.32Å; L274-E294 HydrophobicContact CD2-CG 3.87Å; L274-E294 WeakPolarHBondContact CD2-O 3.16Å
275	I	64.7	Low	73.9	Confident	54 Å²	54	68.6 Å²	68.6	28%	0.277	35%	0.354	S	S	.	.	P	Polyproline II helix	trans	-77	116.2	173.2	-64.2	173.6	0	0	0	109.9	G265 Y277 I280	G265-I275 WeakPolarHBondContact O-CG1 3.27Å; G265-I275 PolarHBondContact O-N 3.44Å; I275-Y277 HydrophobicContact CG2-CE1 4.47Å; I275-Y277 VanDerWaalsContact O-CD2 3.27Å; I275-Y277 WeakPolarHBondContact O-CD2 3.46Å; I275-Y277 WeakPolarHBondContact O-CE2 3.5Å; I275-Y277 PolarHBondContact O-N 2.8Å; I275-Y277 VanDerWaalsContact O-N 3.15Å; I275-I280 HydrophobicContact CG2-CD1 3.7Å
276	D	66.4	Low	74.8	Confident	65 Å²	65	72.2 Å²	72.2	35%	0.348	37%	0.372	S	S	.	.			trans	-76.3	99.4	171.9	-171.6	-31.5	0	0	0	110.9	L274 C278 V279 I280	L274-D276 PolarHBondContact O-N 3.03Å; D276-C278 VanDerWaalsContact C-N 3.26Å; D276-C278 PolarHBondContact O-N 3.4Å; D276-C278 WeakPolarHBondContact OD1-CA 3.3Å; D276-C278 VanDerWaalsContact OD1-CB 3.27Å; D276-C278 WeakPolarHBondContact OD1-CB 3.44Å; D276-C278 PolarHBondContact OD1-N 3.17Å; D276-V279 HydrophobicContact CB-CB 4.4Å; D276-V279 HydrophobicContact CB-CG2 4.32Å; D276-V279 PolarHBondContact OD1-N 3.38Å; D276-V279 VanDerWaalsContact OD1-N 3.08Å; D276-I280 WeakPolarHBondContact O-CG1 3.41Å; D276-I280 PolarHBondContact O-N 3.15Å
277	Y	69.8	Low	75.3	Confident	49 Å²	49	74 Å²	74	19%	0.192	40%	0.4	C	S	.	.	H	α-helix	trans	-63.4	-27.7	177.6	-63.9	-83.2	0	0	0	113.8	I275 Y281 D296	I275-Y277 HydrophobicContact CG2-CE1 4.47Å; I275-Y277 VanDerWaalsContact O-CD2 3.27Å; I275-Y277 WeakPolarHBondContact O-CD2 3.46Å; I275-Y277 WeakPolarHBondContact O-CE2 3.5Å; I275-Y277 PolarHBondContact O-N 2.8Å; I275-Y277 VanDerWaalsContact O-N 3.15Å; Y277-Y281 HydrophobicContact CD1-CD2 4.1Å; Y277-Y281 HydrophobicContact CD1-CE2 4.01Å; Y277-Y281 PolarHBondContact O-N 3.26Å; Y277-Y281 VanDerWaalsContact O-N 3.09Å; Y277-D296 WeakPolarHBondContact CD2-O 3.47Å
278	C	76.3	Confident	76	Confident	18 Å²	18	71.6 Å²	71.6	12%	0.122	39%	0.387	C	S	.	.	H	α-helix	trans	-72.5	-39.7	-178.2	-69.9	0	0	0	0	112	D276 T282 C290	D276-C278 VanDerWaalsContact C-N 3.26Å; D276-C278 PolarHBondContact O-N 3.4Å; D276-C278 WeakPolarHBondContact OD1-CA 3.3Å; D276-C278 VanDerWaalsContact OD1-CB 3.27Å; D276-C278 WeakPolarHBondContact OD1-CB 3.44Å; D276-C278 PolarHBondContact OD1-N 3.17Å; C278-T282 PolarHBondContact O-N 3.01Å; C278-C290 WeakPolarHBondContact CA-SG 3.5Å; C278-C290 HydrophobicContact CB-CB 3.61Å; C278-C290 WeakPolarHBondContact CB-SG 3.44Å; C278-C290 WeakPolarHBondContact SG-CB 3.29Å; C278-C290 CovalentContact SG-SG 2.03Å; C278-C290 PolarHBondContact SG-SG 2.89Å
279	V	72	Confident	76.7	Confident	111 Å²	111	77 Å²	77	67%	0.673	40%	0.404	S	S	*	.	H	α-helix	trans	-71.3	-37.8	176.9	176.1	0	0	0	0	111.9	D276	D276-V279 HydrophobicContact CB-CB 4.4Å; D276-V279 HydrophobicContact CB-CG2 4.32Å; D276-V279 PolarHBondContact OD1-N 3.38Å; D276-V279 VanDerWaalsContact OD1-N 3.08Å
280	I	69.7	Low	77.3	Confident	104 Å²	104	71.3 Å²	71.3	53%	0.533	38%	0.384	S	S	.	.	H	α-helix	trans	-82.8	-40.4	-172.9	-64.4	172.3	0	0	0	112.8	I275 D276	I275-I280 HydrophobicContact CG2-CD1 3.7Å; D276-I280 WeakPolarHBondContact O-CG1 3.41Å; D276-I280 PolarHBondContact O-N 3.15Å
281	Y	73.4	Confident	77.5	Confident	147 Å²	147	71.7 Å²	71.7	58%	0.576	39%	0.388	S	S	*	.	H	α-helix	trans	-110	-12.4	-170	-64.2	-74.6	0	0	0	114.7	Y277 P283	Y277-Y281 HydrophobicContact CD1-CD2 4.1Å; Y277-Y281 HydrophobicContact CD1-CE2 4.01Å; Y277-Y281 PolarHBondContact O-N 3.26Å; Y277-Y281 VanDerWaalsContact O-N 3.09Å; Y281-P283 VanDerWaalsContact C-N 3.32Å
282	T	78.8	Confident	77.3	Confident	111 Å²	111	75.1 Å²	75.1	68%	0.681	41%	0.41	S	S	*	.			trans	38.8	54.8	-175.7	56.6	0	0	0	0	113.4	C278 C284	C278-T282 PolarHBondContact O-N 3.01Å; T282-C284 PolarHBondContact O-N 3.08Å
283	P	83.4	Confident	77.5	Confident	10 Å²	10	75.1 Å²	75.1	7%	0.065	41%	0.406	C	S	.	.			trans	-76.3	-20.1	-159.2	29.3	-36.2	0	0	0	114.8	Y281 Y297 N309	Y281-P283 VanDerWaalsContact C-N 3.32Å; P283-Y297 HydrophobicContact CB-CD1 4.37Å; P283-Y297 HydrophobicContact CB-CD2 3.94Å; P283-Y297 HydrophobicContact CB-CE1 3.92Å; P283-Y297 HydrophobicContact CB-CE2 3.43Å; P283-Y297 VanDerWaalsContact CB-CE2 3.43Å; P283-Y297 HydrophobicContact CB-CG 4.38Å; P283-Y297 VanDerWaalsContact CB-CZ 3.41Å; P283-Y297 HydrophobicContact CG-CD1 3.86Å; P283-Y297 HydrophobicContact CG-CD2 3.39Å; P283-Y297 HydrophobicContact CG-CE1 3.92Å; P283-Y297 HydrophobicContact CG-CE2 3.47Å; P283-Y297 VanDerWaalsContact CG-CE2 3.47Å; P283-Y297 HydrophobicContact CG-CG 3.59Å; P283-N309 WeakPolarHBondContact O-CB 3.22Å; P283-N309 PolarHBondContact O-ND2 3.45Å
284	C	88.4	Confident	77.4	Confident	22 Å²	22	75.8 Å²	75.8	15%	0.149	41%	0.409	C	S	.	.			trans	-82.4	120.7	-176.5	-47.1	0	0	0	0	111.1	T282 G288 C290 C299	T282-C284 PolarHBondContact O-N 3.08Å; C284-G288 VanDerWaalsContact CB-O 3.29Å; C284-G288 WeakPolarHBondContact CB-O 3.34Å; C284-C290 VanDerWaalsContact SG-CA 3.52Å; C284-C290 WeakPolarHBondContact SG-CB 3.36Å; C284-C299 WeakPolarHBondContact CA-SG 3.47Å; C284-C299 HydrophobicContact CB-CB 3.79Å; C284-C299 WeakPolarHBondContact CB-SG 3.3Å; C284-C299 VanDerWaalsContact SG-CA 3.55Å; C284-C299 WeakPolarHBondContact SG-CB 3.45Å; C284-C299 CovalentContact SG-SG 2.03Å; C284-C299 PolarHBondContact SG-SG 2.8Å
285	Q	85.8	Confident	77.4	Confident	113 Å²	113	76.1 Å²	76.1	53%	0.528	42%	0.419	S	S	.	.			trans	-97	179.3	177.3	-58.3	-163	3.8	0	0	111.4	G287 G288 N309 T311	Q285-G287 PolarHBondContact O-N 2.85Å; Q285-G288 PolarHBondContact O-N 3.32Å; Q285-N309 PolarHBondContact N-O 2.99Å; Q285-T311 HydrophobicContact CB-CG2 3.91Å; Q285-T311 HydrophobicContact CG-CG2 3.86Å
286	N	82.8	Confident	77.9	Confident	80 Å²	80	76.4 Å²	76.4	43%	0.428	42%	0.421	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.6	17.8	176.5	-59.7	-42.3	0	0	0	116.2	P302 Y305 C310	N286-P302 WeakPolarHBondContact O-CG 3.42Å; N286-Y305 HydrophobicContact CB-CD1 4.02Å; N286-Y305 HydrophobicContact CB-CD2 4.03Å; N286-Y305 HydrophobicContact CB-CE1 3.89Å; N286-Y305 HydrophobicContact CB-CE2 3.86Å; N286-Y305 HydrophobicContact CB-CG 4.08Å; N286-Y305 WeakPolarHBondContact ND2-CD1 3.34Å; N286-Y305 WeakPolarHBondContact ND2-CE1 3.42Å; N286-C310 PolarHBondContact ND2-O 2.94Å
287	G	81.9	Confident	78.6	Confident	67 Å²	67	75.3 Å²	75.3	69%	0.691	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	92.5	10.9	-179.3	0	0	0	0	0	115.3	Q285	Q285-G287 PolarHBondContact O-N 2.85Å
288	G	86.5	Confident	79.4	Confident	14 Å²	14	77.8 Å²	77.8	14%	0.144	43%	0.425	C	S	.	.	P	Polyproline II helix	trans	-63	143.4	173.5	0	0	0	0	0	113.2	C284 Q285 E300	C284-G288 VanDerWaalsContact CB-O 3.29Å; C284-G288 WeakPolarHBondContact CB-O 3.34Å; Q285-G288 PolarHBondContact O-N 3.32Å; G288-E300 CarbonylContact C-O 3.54Å; G288-E300 WeakPolarHBondContact CA-O 3.46Å
289	K	88	Confident	80	Confident	138 Å²	138	77.3 Å²	77.3	60%	0.6	42%	0.422	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90	130.6	178.3	-56.5	174.6	-169.2	160.7	0	110.3	C299 E300	K289-C299 CarbonylContact O-C 3.6Å; K289-C299 WeakPolarHBondContact O-CA 3.41Å; K289-E300 HydrophobicContact CB-CB 4.28Å; K289-E300 WeakPolarHBondContact CD-OE2 3.43Å; K289-E300 PolarHBondContact N-O 3.46Å; K289-E300 PolarHBondContact O-N 2.03Å
290	C	87.6	Confident	80.9	Confident	39 Å²	39	76.1 Å²	76.1	26%	0.264	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	131.4	178.3	-162.9	0	0	0	0	111.4	C278 C284	C278-C290 WeakPolarHBondContact CA-SG 3.5Å; C278-C290 HydrophobicContact CB-CB 3.61Å; C278-C290 WeakPolarHBondContact CB-SG 3.44Å; C278-C290 WeakPolarHBondContact SG-CB 3.29Å; C278-C290 CovalentContact SG-SG 2.03Å; C278-C290 PolarHBondContact SG-SG 2.89Å; C284-C290 VanDerWaalsContact SG-CA 3.52Å; C284-C290 WeakPolarHBondContact SG-CB 3.36Å
291	H	84.6	Confident	81.7	Confident	75 Å²	75	73.3 Å²	73.3	35%	0.347	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	125.5	171.1	-64.5	-89.1	0	0	0	109.4	Y297 H298 E300	H291-Y297 WeakPolarHBondContact O-CA 3.36Å; H291-H298 PolarHBondContact N-O 3.22Å; H291-H298 PolarHBondContact O-N 3.08Å; H291-E300 IonicContact CD2-OE2 2.68Å; H291-E300 IonicContact CE1-OE2 3.24Å; H291-E300 IonicContact NE2-OE1 3.15Å; H291-E300 IonicContact NE2-OE2 2.71Å; H291-E300 PolarHBondContact NE2-OE2 3.15Å
292	P	75.5	Confident	82.2	Confident	72 Å²	72	68.5 Å²	68.5	47%	0.468	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	146.8	-179.6	29.9	-34.2	0	0	0	111.8
293	L	76.5	Confident	82.4	Confident	93 Å²	93	66.6 Å²	66.6	49%	0.487	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	167.5	175	-60.1	174.4	0	0	0	110.2	S295 D296 H298	L293-S295 PolarHBondContact O-N 2.83Å; L293-D296 WeakPolarHBondContact CA-O 3.43Å; L293-D296 HydrophobicContact CB-CB 4.4Å; L293-D296 WeakPolarHBondContact CB-O 3.41Å; L293-D296 HydrophobicContact CD1-CB 4.49Å; L293-D296 PolarHBondContact N-O 2.94Å; L293-D296 PolarHBondContact O-N 2.97Å; L293-H298 HydrophobicContact CD1-CB 4.11Å
294	E	66.5	Low	82.2	Confident	126 Å²	126	66.2 Å²	66.2	59%	0.589	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.1	-20.5	-172.1	-163	176.6	-174.1	0	0	114.9	L274	L274-E294 HydrophobicContact CD2-CB 4.32Å; L274-E294 HydrophobicContact CD2-CG 3.87Å; L274-E294 WeakPolarHBondContact CD2-O 3.16Å
295	S	67.1	Low	82.1	Confident	90 Å²	90	67.1 Å²	67.1	63%	0.629	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-151.5	19.6	173.8	-61.8	0	0	0	0	112.7	L293	L293-S295 PolarHBondContact O-N 2.83Å
296	D	74.2	Confident	82.1	Confident	61 Å²	61	66.7 Å²	66.7	33%	0.326	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.2	-170	-173.6	-152.9	-5	0	0	0	111.6	Y277 L293 K308	Y277-D296 WeakPolarHBondContact CD2-O 3.47Å; L293-D296 WeakPolarHBondContact CA-O 3.43Å; L293-D296 HydrophobicContact CB-CB 4.4Å; L293-D296 WeakPolarHBondContact CB-O 3.41Å; L293-D296 HydrophobicContact CD1-CB 4.49Å; L293-D296 PolarHBondContact N-O 2.94Å; L293-D296 PolarHBondContact O-N 2.97Å; D296-K308 WeakPolarHBondContact OD1-CE 3.49Å; D296-K308 IonicContact OD1-NZ 2.69Å; D296-K308 PolarHBondContact OD1-NZ 2.84Å; D296-K308 IonicContact OD2-NZ 2.57Å; D296-K308 PolarHBondContact OD2-NZ 3.41Å
297	Y	82.3	Confident	82.2	Confident	41 Å²	41	64.5 Å²	64.5	16%	0.161	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	154.6	167.9	56.3	-89.3	0	0	0	111.2	P283 H291 K308 N309	P283-Y297 HydrophobicContact CB-CD1 4.37Å; P283-Y297 HydrophobicContact CB-CD2 3.94Å; P283-Y297 HydrophobicContact CB-CE1 3.92Å; P283-Y297 HydrophobicContact CB-CE2 3.43Å; P283-Y297 VanDerWaalsContact CB-CE2 3.43Å; P283-Y297 HydrophobicContact CB-CG 4.38Å; P283-Y297 VanDerWaalsContact CB-CZ 3.41Å; P283-Y297 HydrophobicContact CG-CD1 3.86Å; P283-Y297 HydrophobicContact CG-CD2 3.39Å; P283-Y297 HydrophobicContact CG-CE1 3.92Å; P283-Y297 HydrophobicContact CG-CE2 3.47Å; P283-Y297 VanDerWaalsContact CG-CE2 3.47Å; P283-Y297 HydrophobicContact CG-CG 3.59Å; H291-Y297 WeakPolarHBondContact O-CA 3.36Å; Y297-K308 HydrophobicContact CE2-CD 4.43Å; Y297-K308 HydrophobicContact CE2-CG 4.01Å; Y297-N309 PolarHBondContact OH-ND2 3.42Å; Y297-N309 PolarHBondContact OH-OD1 2.84Å
298	H	86.3	Confident	82.3	Confident	101 Å²	101	66.3 Å²	66.3	47%	0.468	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	132.4	167.2	173.8	60.2	0	0	0	110.1	H291 L293	H291-H298 PolarHBondContact N-O 3.22Å; H291-H298 PolarHBondContact O-N 3.08Å; L293-H298 HydrophobicContact CD1-CB 4.11Å
299	C	89.3	Confident	82.4	Confident	8 Å²	8	67.7 Å²	67.7	5%	0.054	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	116.8	171.1	-63.1	0	0	0	0	110.5	C284 K289 C301 K308 C310	C284-C299 WeakPolarHBondContact CA-SG 3.47Å; C284-C299 HydrophobicContact CB-CB 3.79Å; C284-C299 WeakPolarHBondContact CB-SG 3.3Å; C284-C299 VanDerWaalsContact SG-CA 3.55Å; C284-C299 WeakPolarHBondContact SG-CB 3.45Å; C284-C299 CovalentContact SG-SG 2.03Å; C284-C299 PolarHBondContact SG-SG 2.8Å; K289-C299 CarbonylContact O-C 3.6Å; K289-C299 WeakPolarHBondContact O-CA 3.41Å; C299-C301 PolarHBondContact O-N 2.97Å; C299-K308 WeakPolarHBondContact CB-O 3.22Å; C299-K308 PolarHBondContact SG-O 2.97Å; C299-C310 VanDerWaalsContact CB-SG 3.5Å
300	E	89.3	Confident	82.3	Confident	86 Å²	86	61.1 Å²	61.1	40%	0.402	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74	104.6	163.2	-74.9	179.7	150.8	0	0	108.2	G288 K289 H291	G288-E300 CarbonylContact C-O 3.54Å; G288-E300 WeakPolarHBondContact CA-O 3.46Å; K289-E300 HydrophobicContact CB-CB 4.28Å; K289-E300 WeakPolarHBondContact CD-OE2 3.43Å; K289-E300 PolarHBondContact N-O 3.46Å; K289-E300 PolarHBondContact O-N 2.03Å; H291-E300 IonicContact CD2-OE2 2.68Å; H291-E300 IonicContact CE1-OE2 3.24Å; H291-E300 IonicContact NE2-OE1 3.15Å; H291-E300 IonicContact NE2-OE2 2.71Å; H291-E300 PolarHBondContact NE2-OE2 3.15Å
301	C	87.9	Confident	82.2	Confident	45 Å²	45	62.6 Å²	62.6	30%	0.304	35%	0.345	S	S	.	.	P	Polyproline II helix	trans	-79	143.4	-178.5	-56.9	0	0	0	0	112.6	C299 Y305 C310	C299-C301 PolarHBondContact O-N 2.97Å; C301-Y305 VanDerWaalsContact CB-O 3.24Å; C301-Y305 WeakPolarHBondContact CB-O 3.48Å; C301-C310 WeakPolarHBondContact CA-SG 3.23Å; C301-C310 HydrophobicContact CB-CB 3.72Å; C301-C310 WeakPolarHBondContact CB-SG 3.45Å; C301-C310 WeakPolarHBondContact SG-CA 3.48Å; C301-C310 WeakPolarHBondContact SG-CB 3.06Å; C301-C310 CovalentContact SG-SG 2.04Å; C301-C310 PolarHBondContact SG-SG 2.91Å
302	P	84	Confident	82.2	Confident	47 Å²	47	62.9 Å²	62.9	31%	0.305	35%	0.348	S	S	.	.	P	Polyproline II helix	trans	-69.7	156.4	168.8	29.2	-29.7	0	0	0	110.1	N286 G304 Y305	N286-P302 WeakPolarHBondContact O-CG 3.42Å; P302-G304 PolarHBondContact O-N 3.36Å; P302-Y305 HydrophobicContact CG-CD2 4Å; P302-Y305 PolarHBondContact O-N 2.74Å; P302-Y305 VanDerWaalsContact O-N 3.13Å
303	A	82	Confident	82.5	Confident	71 Å²	71	61.5 Å²	61.5	59%	0.587	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.7	138.3	-179.7	0	0	0	0	0	111.3	N333	A303-N333 WeakPolarHBondContact CB-OD1 3.37Å
304	G	80.1	Confident	82.8	Confident	1 Å²	1	60 Å²	60	1%	0.01	33%	0.329	C	S	.	.	T	Hydrogen-bonded Turn	trans	92.9	-9.4	-169.9	0	0	0	0	0	115.4	P302 N313 I314 N333	P302-G304 PolarHBondContact O-N 3.36Å; G304-N313 WeakPolarHBondContact O-CA 3.09Å; G304-N313 PolarHBondContact O-OD1 3Å; G304-I314 PolarHBondContact O-N 2.91Å; G304-N333 PolarHBondContact N-OD1 2.88Å
305	Y	86.8	Confident	83.6	Confident	42 Å²	42	58 Å²	58	17%	0.165	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	142.3	-178.8	-67.1	-81	0	0	0	114.4	N286 C301 P302 C310 I312 I332	N286-Y305 HydrophobicContact CB-CD1 4.02Å; N286-Y305 HydrophobicContact CB-CD2 4.03Å; N286-Y305 HydrophobicContact CB-CE1 3.89Å; N286-Y305 HydrophobicContact CB-CE2 3.86Å; N286-Y305 HydrophobicContact CB-CG 4.08Å; N286-Y305 WeakPolarHBondContact ND2-CD1 3.34Å; N286-Y305 WeakPolarHBondContact ND2-CE1 3.42Å; C301-Y305 VanDerWaalsContact CB-O 3.24Å; C301-Y305 WeakPolarHBondContact CB-O 3.48Å; P302-Y305 HydrophobicContact CG-CD2 4Å; P302-Y305 PolarHBondContact O-N 2.74Å; P302-Y305 VanDerWaalsContact O-N 3.13Å; Y305-C310 WeakPolarHBondContact CD1-O 3.39Å; Y305-I312 CarbonylContact C-O 3.6Å; Y305-I312 VanDerWaalsContact CA-O 3.31Å; Y305-I312 WeakPolarHBondContact CA-O 3.19Å; Y305-I332 HydrophobicContact CD2-CG2 4.45Å; Y305-I332 HydrophobicContact CE2-CG2 3.55Å; Y305-I332 WeakPolarHBondContact OH-CD1 3.41Å
306	E	84.9	Confident	84.4	Confident	103 Å²	103	55.7 Å²	55.7	48%	0.481	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	-171.5	175.4	69.1	155.7	-145.8	0	0	113.3	C310 T311 I312 I314	E306-C310 CarbonylContact O-C 3.57Å; E306-C310 VanDerWaalsContact O-CA 3.3Å; E306-C310 WeakPolarHBondContact O-CA 3.35Å; E306-T311 PolarHBondContact O-N 2.84Å; E306-I312 HydrophobicContact CG-CB 3.96Å; E306-I312 HydrophobicContact CG-CG2 3.81Å; E306-I312 PolarHBondContact N-O 2.84Å; E306-I312 PolarHBondContact O-N 3.18Å; E306-I314 HydrophobicContact CB-CD1 4.47Å; E306-I314 HydrophobicContact CB-CG1 3.94Å; E306-I314 HydrophobicContact CG-CG1 3.92Å
307	G	84.5	Confident	85.1	Confident	34 Å²	34	53.8 Å²	53.8	35%	0.351	29%	0.293	S	S	.	.	S	Bend	trans	79.4	159.9	-172.5	0	0	0	0	0	112.8	N309 C310	G307-N309 PolarHBondContact O-N 3.44Å; G307-C310 PolarHBondContact O-N 3.11Å
308	K	84.3	Confident	85.2	Confident	105 Å²	105	59 Å²	59	46%	0.457	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.6	-26.8	-173.3	-179.6	169.7	172.2	173	0	114.5	D296 Y297 C299	D296-K308 WeakPolarHBondContact OD1-CE 3.49Å; D296-K308 IonicContact OD1-NZ 2.69Å; D296-K308 PolarHBondContact OD1-NZ 2.84Å; D296-K308 IonicContact OD2-NZ 2.57Å; D296-K308 PolarHBondContact OD2-NZ 3.41Å; Y297-K308 HydrophobicContact CE2-CD 4.43Å; Y297-K308 HydrophobicContact CE2-CG 4.01Å; C299-K308 WeakPolarHBondContact CB-O 3.22Å; C299-K308 PolarHBondContact SG-O 2.97Å
309	N	87.7	Confident	85.1	Confident	43 Å²	43	61.5 Å²	61.5	23%	0.23	34%	0.335	C	S	.	.	T	Hydrogen-bonded Turn	trans	-113.2	9.6	-176.5	-66.4	57	0	0	0	112.8	P283 Q285 Y297 G307 T311	P283-N309 WeakPolarHBondContact O-CB 3.22Å; P283-N309 PolarHBondContact O-ND2 3.45Å; Q285-N309 PolarHBondContact N-O 2.99Å; Y297-N309 PolarHBondContact OH-ND2 3.42Å; Y297-N309 PolarHBondContact OH-OD1 2.84Å; G307-N309 PolarHBondContact O-N 3.44Å; N309-T311 HydrophobicContact CB-CG2 3.82Å; N309-T311 PolarHBondContact O-N 3.02Å
310	C	87.3	Confident	84.8	Confident	0 Å²	0	64.8 Å²	64.8	0%	0	35%	0.353	C	S	.	.	S	Bend	trans	57.7	28.9	-174.7	-45.8	0	0	0	0	114.2	N286 C299 C301 Y305 E306 G307	N286-C310 PolarHBondContact ND2-O 2.94Å; C299-C310 VanDerWaalsContact CB-SG 3.5Å; C301-C310 WeakPolarHBondContact CA-SG 3.23Å; C301-C310 HydrophobicContact CB-CB 3.72Å; C301-C310 WeakPolarHBondContact CB-SG 3.45Å; C301-C310 WeakPolarHBondContact SG-CA 3.48Å; C301-C310 WeakPolarHBondContact SG-CB 3.06Å; C301-C310 CovalentContact SG-SG 2.04Å; C301-C310 PolarHBondContact SG-SG 2.91Å; Y305-C310 WeakPolarHBondContact CD1-O 3.39Å; E306-C310 CarbonylContact O-C 3.57Å; E306-C310 VanDerWaalsContact O-CA 3.3Å; E306-C310 WeakPolarHBondContact O-CA 3.35Å; G307-C310 PolarHBondContact O-N 3.11Å
311	T	85.4	Confident	84.6	Confident	70 Å²	70	61.8 Å²	61.8	43%	0.429	34%	0.34	S	S	.	.			trans	-91.9	-12	-174.2	47.7	0	0	0	0	114.1	Q285 E306 N309	Q285-T311 HydrophobicContact CB-CG2 3.91Å; Q285-T311 HydrophobicContact CG-CG2 3.86Å; E306-T311 PolarHBondContact O-N 2.84Å; N309-T311 HydrophobicContact CB-CG2 3.82Å; N309-T311 PolarHBondContact O-N 3.02Å
312	I	83.3	Confident	84.5	Confident	81 Å²	81	59.6 Å²	59.6	42%	0.415	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	128.8	-175.8	-58.6	173.8	0	0	0	107.5	Y305 E306	Y305-I312 CarbonylContact C-O 3.6Å; Y305-I312 VanDerWaalsContact CA-O 3.31Å; Y305-I312 WeakPolarHBondContact CA-O 3.19Å; E306-I312 HydrophobicContact CG-CB 3.96Å; E306-I312 HydrophobicContact CG-CG2 3.81Å; E306-I312 PolarHBondContact N-O 2.84Å; E306-I312 PolarHBondContact O-N 3.18Å
313	N	82.7	Confident	84.5	Confident	44 Å²	44	59.1 Å²	59.1	24%	0.235	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	136	167.7	-161.2	71.4	0	0	0	108.1	G304 D315 D330 G331	G304-N313 WeakPolarHBondContact O-CA 3.09Å; G304-N313 PolarHBondContact O-OD1 3Å; N313-D315 PolarHBondContact O-N 2.94Å; N313-D330 PolarHBondContact ND2-OD2 2.04Å; N313-G331 PolarHBondContact ND2-O 3.31Å
314	I	82.6	Confident	84.6	Confident	62 Å²	62	59.9 Å²	59.9	32%	0.318	34%	0.335	S	S	.	.	P	Polyproline II helix	trans	-68.5	120.8	173.3	-61.6	171.3	0	0	0	107.1	G304 E306 E316	G304-I314 PolarHBondContact O-N 2.91Å; E306-I314 HydrophobicContact CB-CD1 4.47Å; E306-I314 HydrophobicContact CB-CG1 3.94Å; E306-I314 HydrophobicContact CG-CG1 3.92Å; I314-E316 VanDerWaalsContact C-N 3.35Å; I314-E316 HydrophobicContact CB-CG 4.44Å; I314-E316 HydrophobicContact CG2-CG 4.08Å; I314-E316 PolarHBondContact O-N 3.26Å
315	D	83.5	Confident	84.7	Confident	82 Å²	82	62.8 Å²	62.8	44%	0.439	35%	0.349	S	S	.	.			trans	-71	91.6	174.8	175.4	8.3	0	0	0	109.3	N313 C317 H318	N313-D315 PolarHBondContact O-N 2.94Å; D315-C317 PolarHBondContact O-N 3.24Å; D315-C317 WeakPolarHBondContact OD1-CA 3.32Å; D315-C317 WeakPolarHBondContact OD1-CB 3.12Å; D315-C317 PolarHBondContact OD1-N 2.94Å; D315-H318 HydrophobicContact CB-CB 4.44Å; D315-H318 WeakPolarHBondContact O-CB 3.47Å; D315-H318 PolarHBondContact O-N 3.1Å; D315-H318 PolarHBondContact OD1-N 2.91Å; D315-H318 VanDerWaalsContact OD1-N 3.14Å; D315-H318 IonicContact OD2-ND1 3.64Å
316	E	84.4	Confident	84.6	Confident	42 Å²	42	61.3 Å²	61.3	20%	0.196	35%	0.346	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.6	-3.4	-177.7	-70.7	155	-169	0	0	111.7	I314 P321 D330 N333 K334 Y335	I314-E316 VanDerWaalsContact C-N 3.35Å; I314-E316 HydrophobicContact CB-CG 4.44Å; I314-E316 HydrophobicContact CG2-CG 4.08Å; I314-E316 PolarHBondContact O-N 3.26Å; E316-P321 WeakPolarHBondContact O-CG 3.09Å; E316-D330 PolarHBondContact N-OD1 3.42Å; E316-N333 VanDerWaalsContact OE1-CA 3.24Å; E316-N333 WeakPolarHBondContact OE1-CA 3.32Å; E316-N333 PolarHBondContact OE1-N 3.09Å; E316-N333 VanDerWaalsContact OE2-C 3.28Å; E316-K334 WeakPolarHBondContact OE2-CA 3.31Å; E316-K334 PolarHBondContact OE2-N 3.29Å; E316-Y335 HydrophobicContact CB-CD1 4.32Å
317	C	87.8	Confident	84.8	Confident	22 Å²	22	60.9 Å²	60.9	15%	0.149	35%	0.35	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.4	-6.3	171	-70.3	0	0	0	0	114	D315 D319 N320 C328 E329 D330	D315-C317 PolarHBondContact O-N 3.24Å; D315-C317 WeakPolarHBondContact OD1-CA 3.32Å; D315-C317 WeakPolarHBondContact OD1-CB 3.12Å; D315-C317 PolarHBondContact OD1-N 2.94Å; C317-D319 PolarHBondContact O-N 3.35Å; C317-N320 WeakPolarHBondContact O-CA 3.46Å; C317-N320 PolarHBondContact O-N 3.15Å; C317-C328 WeakPolarHBondContact CA-SG 3.25Å; C317-C328 HydrophobicContact CB-CB 3.65Å; C317-C328 WeakPolarHBondContact CB-SG 3.11Å; C317-C328 WeakPolarHBondContact SG-CB 3.41Å; C317-C328 CovalentContact SG-SG 2.03Å; C317-C328 PolarHBondContact SG-SG 3.4Å; C317-E329 VanDerWaalsContact SG-C 3.52Å; C317-D330 PolarHBondContact SG-N 2.84Å; C317-D330 VanDerWaalsContact SG-N 3.41Å
318	H	85.1	Confident	85	Confident	149 Å²	149	60.6 Å²	60.6	69%	0.69	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.1	-47.2	-174.8	-169.5	82.4	0	0	0	114.1	D315 N320	D315-H318 HydrophobicContact CB-CB 4.44Å; D315-H318 WeakPolarHBondContact O-CB 3.47Å; D315-H318 PolarHBondContact O-N 3.1Å; D315-H318 PolarHBondContact OD1-N 2.91Å; D315-H318 VanDerWaalsContact OD1-N 3.14Å; D315-H318 IonicContact OD2-ND1 3.64Å; H318-N320 PolarHBondContact O-N 3.15Å
319	D	84.5	Confident	85.2	Confident	155 Å²	155	59.6 Å²	59.6	83%	0.829	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.2	7.1	177.9	-76.6	-24.4	0	0	0	113.4	C317	C317-D319 PolarHBondContact O-N 3.35Å
320	N	82.2	Confident	84.9	Confident	77 Å²	77	61.1 Å²	61.1	41%	0.412	35%	0.348	S	S	.	.			trans	43.6	68.5	-170.2	-174.5	23.1	0	0	0	113.6	C317 H318 C322 G323	C317-N320 WeakPolarHBondContact O-CA 3.46Å; C317-N320 PolarHBondContact O-N 3.15Å; H318-N320 PolarHBondContact O-N 3.15Å; N320-C322 PolarHBondContact O-N 2.96Å; N320-G323 PolarHBondContact ND2-O 2.87Å; N320-G323 PolarHBondContact O-N 3.36Å; N320-G323 VanDerWaalsContact O-N 3.16Å
321	P	85.8	Confident	84.6	Confident	22 Å²	22	62 Å²	62	14%	0.143	36%	0.356	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-14.6	-176.1	29.4	-37.9	0	0	0	114	E316 G323 Y335 K347	E316-P321 WeakPolarHBondContact O-CG 3.09Å; P321-G323 VanDerWaalsContact C-N 3.33Å; P321-Y335 HydrophobicContact CB-CD2 4.16Å; P321-Y335 HydrophobicContact CB-CE1 4.13Å; P321-Y335 HydrophobicContact CB-CE2 3.71Å; P321-Y335 HydrophobicContact CG-CD1 4.04Å; P321-Y335 HydrophobicContact CG-CD2 3.59Å; P321-Y335 HydrophobicContact CG-CE1 4.14Å; P321-Y335 HydrophobicContact CG-CE2 3.69Å; P321-Y335 HydrophobicContact CG-CG 3.78Å; P321-K347 WeakPolarHBondContact O-CB 3.46Å; P321-K347 WeakPolarHBondContact O-CD 3.45Å; P321-K347 WeakPolarHBondContact O-CE 3.02Å; P321-K347 WeakPolarHBondContact O-CG 3.38Å
322	C	85.5	Confident	84.3	Confident	0 Å²	0	63.4 Å²	63.4	0%	0	36%	0.36	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.5	3.1	179.8	-54.6	0	0	0	0	114.3	N320 G326 C328 C337 K347	N320-C322 PolarHBondContact O-N 2.96Å; C322-G326 VanDerWaalsContact CB-O 3.26Å; C322-G326 WeakPolarHBondContact CB-O 3.19Å; C322-G326 PolarHBondContact O-N 3.21Å; C322-C328 HydrophobicContact CB-CB 4.31Å; C322-C328 VanDerWaalsContact SG-CA 3.56Å; C322-C328 WeakPolarHBondContact SG-CB 3.01Å; C322-C328 VanDerWaalsContact SG-SG 3.69Å; C322-C337 WeakPolarHBondContact CA-SG 3.06Å; C322-C337 HydrophobicContact CB-CB 3.73Å; C322-C337 WeakPolarHBondContact CB-SG 3.29Å; C322-C337 WeakPolarHBondContact SG-CA 3.39Å; C322-C337 WeakPolarHBondContact SG-CB 3.27Å; C322-C337 CovalentContact SG-SG 2.03Å; C322-C337 PolarHBondContact SG-SG 3.03Å; C322-K347 CarbonylContact C-O 3.49Å
323	G	83.5	Confident	84.1	Confident	36 Å²	36	64 Å²	64	37%	0.371	37%	0.365	S	S	.	.	G	3₁₀ helix	trans	66.8	-154.7	174	0	0	0	0	0	114	N320 P321	N320-G323 PolarHBondContact ND2-O 2.87Å; N320-G323 PolarHBondContact O-N 3.36Å; N320-G323 VanDerWaalsContact O-N 3.16Å; P321-G323 VanDerWaalsContact C-N 3.33Å
324	A	83.8	Confident	84.2	Confident	87 Å²	87	68.3 Å²	68.3	72%	0.719	38%	0.381	S	S	*	.	G	3₁₀ helix	trans	-79.8	-15.1	-176.5	0	0	0	0	0	114.2
325	H	82.4	Confident	84.3	Confident	63 Å²	63	68.6 Å²	68.6	29%	0.292	38%	0.379	S	S	.	.	G	3₁₀ helix	trans	-123.8	23.6	-168.2	-61.7	-58.6	0	0	0	113.8	C339 E340 Y343 C348	H325-C339 WeakPolarHBondContact O-CA 3.26Å; H325-E340 WeakPolarHBondContact CA-OE2 3.49Å; H325-E340 IonicContact CE1-OE2 2.76Å; H325-E340 IonicContact CG-OE2 2.65Å; H325-E340 IonicContact ND1-OE2 3.82Å; H325-E340 PolarHBondContact ND1-OE2 3.37Å; H325-E340 PolarHBondContact O-N 3Å; H325-Y343 HydrophobicContact CB-CD1 4.02Å; H325-Y343 HydrophobicContact CB-CD2 3.57Å; H325-Y343 HydrophobicContact CB-CE1 4.36Å; H325-Y343 HydrophobicContact CB-CE2 3.96Å; H325-Y343 HydrophobicContact CB-CG 3.61Å; H325-Y343 AromaticContact CD2-CE1 3.56Å; H325-Y343 AromaticContact CD2-CE2 3.88Å; H325-Y343 AromaticContact CD2-CZ 3.48Å; H325-Y343 VanDerWaalsContact CD2-CZ 3.48Å; H325-Y343 AromaticContact CE1-CE2 3.91Å; H325-Y343 AromaticContact CE1-CZ 3.84Å; H325-Y343 AromaticContact CG-CD2 3.68Å; H325-Y343 AromaticContact CG-CE1 3.92Å; H325-Y343 AromaticContact CG-CE2 3.51Å; H325-Y343 AromaticContact CG-CG 3.98Å; H325-Y343 AromaticContact CG-CZ 3.63Å; H325-Y343 AromaticContact ND1-CE2 3.53Å; H325-Y343 AromaticContact ND1-CZ 3.85Å; H325-Y343 AromaticContact NE2-CZ 3.64Å; H325-Y343 PolarHBondContact NE2-OH 3.05Å; H325-C348 HydrophobicContact CB-CB 4.45Å; H325-C348 VanDerWaalsContact O-CB 3.3Å; H325-C348 WeakPolarHBondContact O-CB 3.05Å
326	G	85.1	Confident	84.4	Confident	10 Å²	10	68.2 Å²	68.2	10%	0.103	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	131.5	177.2	0	0	0	0	0	112.9	C322 K338	C322-G326 VanDerWaalsContact CB-O 3.26Å; C322-G326 WeakPolarHBondContact CB-O 3.19Å; C322-G326 PolarHBondContact O-N 3.21Å; G326-K338 WeakPolarHBondContact CA-O 3Å
327	T	88.7	Confident	84.6	Confident	95 Å²	95	67.4 Å²	67.4	58%	0.583	38%	0.378	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79	124	169.6	-54.4	0	0	0	0	108.9	K338	T327-K338 PolarHBondContact N-O 3.35Å; T327-K338 PolarHBondContact O-N 3.05Å
328	C	89.5	Confident	84.7	Confident	27 Å²	27	71.8 Å²	71.8	18%	0.182	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	133.3	176.7	-165.8	0	0	0	0	111.2	C317 C322	C317-C328 WeakPolarHBondContact CA-SG 3.25Å; C317-C328 HydrophobicContact CB-CB 3.65Å; C317-C328 WeakPolarHBondContact CB-SG 3.11Å; C317-C328 WeakPolarHBondContact SG-CB 3.41Å; C317-C328 CovalentContact SG-SG 2.03Å; C317-C328 PolarHBondContact SG-SG 3.4Å; C322-C328 HydrophobicContact CB-CB 4.31Å; C322-C328 VanDerWaalsContact SG-CA 3.56Å; C322-C328 WeakPolarHBondContact SG-CB 3.01Å; C322-C328 VanDerWaalsContact SG-SG 3.69Å
329	E	87.8	Confident	84.7	Confident	84 Å²	84	66.9 Å²	66.9	39%	0.393	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	118.9	168.7	-62.6	-167.2	141.6	0	0	109.7	C317 Y335 T336 K338	C317-E329 VanDerWaalsContact SG-C 3.52Å; E329-Y335 CarbonylContact O-C 3.49Å; E329-Y335 WeakPolarHBondContact O-CA 3.34Å; E329-T336 PolarHBondContact N-O 3.1Å; E329-T336 PolarHBondContact O-N 3.4Å; E329-K338 VanDerWaalsContact CD-CE 3.44Å; E329-K338 HydrophobicContact CG-CD 4.33Å; E329-K338 WeakPolarHBondContact OE1-CE 3.36Å; E329-K338 IonicContact OE1-NZ 3.44Å; E329-K338 PolarHBondContact OE1-NZ 3.47Å; E329-K338 WeakPolarHBondContact OE2-CE 3.31Å; E329-K338 IonicContact OE2-NZ 2.66Å; E329-K338 PolarHBondContact OE2-NZ 3.16Å
330	D	82.3	Confident	84.8	Confident	75 Å²	75	64.3 Å²	64.3	40%	0.401	36%	0.359	S	S	.	.			trans	-70.5	159.8	-179	-173.7	50.9	0	0	0	112.4	N313 E316 C317	N313-D330 PolarHBondContact ND2-OD2 2.04Å; E316-D330 PolarHBondContact N-OD1 3.42Å; C317-D330 PolarHBondContact SG-N 2.84Å; C317-D330 VanDerWaalsContact SG-N 3.41Å
331	G	80.7	Confident	84.5	Confident	18 Å²	18	70.2 Å²	70.2	19%	0.186	39%	0.385	C	S	.	.			trans	-168	176.9	-179.3	0	0	0	0	0	112.5	N313 N333 K334	N313-G331 PolarHBondContact ND2-O 3.31Å; G331-N333 PolarHBondContact O-N 3.09Å; G331-N333 VanDerWaalsContact O-N 3.15Å; G331-K334 CarbonylContact C-O 3.57Å; G331-K334 WeakPolarHBondContact CA-O 3.45Å; G331-K334 PolarHBondContact N-O 2.84Å; G331-K334 VanDerWaalsContact N-O 3.09Å
332	I	78.9	Confident	83.8	Confident	100 Å²	100	69.5 Å²	69.5	51%	0.513	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.3	106.4	-178.9	-56.8	162.4	0	0	0	108.7	Y305 K334	Y305-I332 HydrophobicContact CD2-CG2 4.45Å; Y305-I332 HydrophobicContact CE2-CG2 3.55Å; Y305-I332 WeakPolarHBondContact OH-CD1 3.41Å; I332-K334 PolarHBondContact O-N 3.32Å
333	N	79.5	Confident	83.6	Confident	94 Å²	94	71.1 Å²	71.1	50%	0.503	39%	0.387	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.9	33.1	179.3	-163.5	70.5	0	0	0	113.6	A303 G304 E316 G331	A303-N333 WeakPolarHBondContact CB-OD1 3.37Å; G304-N333 PolarHBondContact N-OD1 2.88Å; E316-N333 VanDerWaalsContact OE1-CA 3.24Å; E316-N333 WeakPolarHBondContact OE1-CA 3.32Å; E316-N333 PolarHBondContact OE1-N 3.09Å; E316-N333 VanDerWaalsContact OE2-C 3.28Å; G331-N333 PolarHBondContact O-N 3.09Å; G331-N333 VanDerWaalsContact O-N 3.15Å
334	K	83.6	Confident	83.3	Confident	135 Å²	135	72 Å²	72	59%	0.587	39%	0.386	S	S	*	.			trans	-165.5	141.5	171.5	65.4	-171.8	-177.3	165.2	0	110.6	E316 G331 I332	E316-K334 WeakPolarHBondContact OE2-CA 3.31Å; E316-K334 PolarHBondContact OE2-N 3.29Å; G331-K334 CarbonylContact C-O 3.57Å; G331-K334 WeakPolarHBondContact CA-O 3.45Å; G331-K334 PolarHBondContact N-O 2.84Å; G331-K334 VanDerWaalsContact N-O 3.09Å; I332-K334 PolarHBondContact O-N 3.32Å
335	Y	85.6	Confident	83.1	Confident	68 Å²	68	69.3 Å²	69.3	27%	0.267	37%	0.366	S	S	.	.			trans	-100.1	160.3	158.4	61.7	-85.6	0	0	0	111.3	E316 P321 E329 K347	E316-Y335 HydrophobicContact CB-CD1 4.32Å; P321-Y335 HydrophobicContact CB-CD2 4.16Å; P321-Y335 HydrophobicContact CB-CE1 4.13Å; P321-Y335 HydrophobicContact CB-CE2 3.71Å; P321-Y335 HydrophobicContact CG-CD1 4.04Å; P321-Y335 HydrophobicContact CG-CD2 3.59Å; P321-Y335 HydrophobicContact CG-CE1 4.14Å; P321-Y335 HydrophobicContact CG-CE2 3.69Å; P321-Y335 HydrophobicContact CG-CG 3.78Å; E329-Y335 CarbonylContact O-C 3.49Å; E329-Y335 WeakPolarHBondContact O-CA 3.34Å; Y335-K347 VanDerWaalsContact OH-CE 3.24Å; Y335-K347 WeakPolarHBondContact OH-CE 3.47Å
336	T	85.8	Confident	83	Confident	74 Å²	74	74.4 Å²	74.4	45%	0.454	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	124.5	173.2	-55.1	0	0	0	0	110.4	E329	E329-T336 PolarHBondContact N-O 3.1Å; E329-T336 PolarHBondContact O-N 3.4Å
337	C	89.4	Confident	82.9	Confident	25 Å²	25	77.1 Å²	77.1	17%	0.169	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	121.9	179.3	-61.3	0	0	0	0	112.4	C322 W346	C322-C337 WeakPolarHBondContact CA-SG 3.06Å; C322-C337 HydrophobicContact CB-CB 3.73Å; C322-C337 WeakPolarHBondContact CB-SG 3.29Å; C322-C337 WeakPolarHBondContact SG-CA 3.39Å; C322-C337 WeakPolarHBondContact SG-CB 3.27Å; C322-C337 CovalentContact SG-SG 2.03Å; C322-C337 PolarHBondContact SG-SG 3.03Å; C337-W346 PolarHBondContact SG-O 3.06Å
338	K	88.3	Confident	82.7	Confident	114 Å²	114	72.7 Å²	72.7	50%	0.496	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	98.1	169.2	-79.2	179.5	174.3	161.4	0	110.1	G326 T327 E329	G326-K338 WeakPolarHBondContact CA-O 3Å; T327-K338 PolarHBondContact N-O 3.35Å; T327-K338 PolarHBondContact O-N 3.05Å; E329-K338 VanDerWaalsContact CD-CE 3.44Å; E329-K338 HydrophobicContact CG-CD 4.33Å; E329-K338 WeakPolarHBondContact OE1-CE 3.36Å; E329-K338 IonicContact OE1-NZ 3.44Å; E329-K338 PolarHBondContact OE1-NZ 3.47Å; E329-K338 WeakPolarHBondContact OE2-CE 3.31Å; E329-K338 IonicContact OE2-NZ 2.66Å; E329-K338 PolarHBondContact OE2-NZ 3.16Å
339	C	86.6	Confident	82.3	Confident	45 Å²	45	76.4 Å²	76.4	30%	0.304	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	145.7	-176.9	-51.4	0	0	0	0	113.8	H325 C348	H325-C339 WeakPolarHBondContact O-CA 3.26Å; C339-C348 WeakPolarHBondContact CA-SG 3.32Å; C339-C348 HydrophobicContact CB-CB 3.66Å; C339-C348 WeakPolarHBondContact CB-SG 3.42Å; C339-C348 WeakPolarHBondContact SG-CA 3Å; C339-C348 WeakPolarHBondContact SG-CB 3.01Å; C339-C348 CovalentContact SG-SG 2.03Å; C339-C348 PolarHBondContact SG-SG 2.72Å
340	E	85.9	Confident	81.8	Confident	101 Å²	101	75.7 Å²	75.7	47%	0.472	38%	0.381	S	S	.	.			trans	-62.6	163	173.4	-67.1	-172.7	131.2	0	0	112.8	H325 G342 Y343	H325-E340 WeakPolarHBondContact CA-OE2 3.49Å; H325-E340 IonicContact CE1-OE2 2.76Å; H325-E340 IonicContact CG-OE2 2.65Å; H325-E340 IonicContact ND1-OE2 3.82Å; H325-E340 PolarHBondContact ND1-OE2 3.37Å; H325-E340 PolarHBondContact O-N 3Å; E340-G342 PolarHBondContact O-N 2.81Å; E340-Y343 HydrophobicContact CB-CD2 4.36Å; E340-Y343 PolarHBondContact O-N 2.99Å; E340-Y343 VanDerWaalsContact O-N 3.1Å
341	Q	76.8	Confident	81.2	Confident	202 Å²	202	74.2 Å²	74.2	94%	0.944	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.6	75	-179.8	-167.7	-179.8	3.7	0	0	112
342	G	71.1	Confident	80.6	Confident	6 Å²	6	76.6 Å²	76.6	6%	0.062	38%	0.377	C	S	.	.	T	Hydrogen-bonded Turn	trans	166.3	-15.2	-176.2	0	0	0	0	0	112.6	E340 K352	E340-G342 PolarHBondContact O-N 2.81Å; G342-K352 WeakPolarHBondContact O-CB 3Å; G342-K352 PolarHBondContact O-N 3.32Å
343	Y	80.7	Confident	80.1	Confident	34 Å²	34	74.3 Å²	74.3	13%	0.133	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	160.8	-172.3	-65.6	-90.2	0	0	0	113.2	H325 E340 C348 V350 E351 K352	H325-Y343 HydrophobicContact CB-CD1 4.02Å; H325-Y343 HydrophobicContact CB-CD2 3.57Å; H325-Y343 HydrophobicContact CB-CE1 4.36Å; H325-Y343 HydrophobicContact CB-CE2 3.96Å; H325-Y343 HydrophobicContact CB-CG 3.61Å; H325-Y343 AromaticContact CD2-CE1 3.56Å; H325-Y343 AromaticContact CD2-CE2 3.88Å; H325-Y343 AromaticContact CD2-CZ 3.48Å; H325-Y343 VanDerWaalsContact CD2-CZ 3.48Å; H325-Y343 AromaticContact CE1-CE2 3.91Å; H325-Y343 AromaticContact CE1-CZ 3.84Å; H325-Y343 AromaticContact CG-CD2 3.68Å; H325-Y343 AromaticContact CG-CE1 3.92Å; H325-Y343 AromaticContact CG-CE2 3.51Å; H325-Y343 AromaticContact CG-CG 3.98Å; H325-Y343 AromaticContact CG-CZ 3.63Å; H325-Y343 AromaticContact ND1-CE2 3.53Å; H325-Y343 AromaticContact ND1-CZ 3.85Å; H325-Y343 AromaticContact NE2-CZ 3.64Å; H325-Y343 PolarHBondContact NE2-OH 3.05Å; E340-Y343 HydrophobicContact CB-CD2 4.36Å; E340-Y343 PolarHBondContact O-N 2.99Å; E340-Y343 VanDerWaalsContact O-N 3.1Å; Y343-C348 WeakPolarHBondContact CD1-O 3.38Å; Y343-V350 CarbonylContact C-O 3.59Å; Y343-V350 WeakPolarHBondContact CA-O 3.32Å; Y343-E351 HydrophobicContact CE1-CB 4.23Å; Y343-K352 WeakPolarHBondContact O-CD 3.2Å; Y343-K352 WeakPolarHBondContact O-CE 3.37Å; Y343-K352 PolarHBondContact O-NZ 3.17Å; Y343-K352 VanDerWaalsContact O-NZ 3.09Å
344	T	77.6	Confident	79.6	Confident	55 Å²	55	72.6 Å²	72.6	34%	0.337	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.8	-178.7	178.5	-165.2	0	0	0	0	109.8	C348 E349 V350 K352	T344-C348 CarbonylContact O-C 3.46Å; T344-C348 VanDerWaalsContact O-C 3.31Å; T344-C348 VanDerWaalsContact O-CA 3.32Å; T344-C348 WeakPolarHBondContact O-CA 3.44Å; T344-E349 PolarHBondContact O-N 2.56Å; T344-V350 HydrophobicContact CG2-CB 3.83Å; T344-V350 HydrophobicContact CG2-CG1 3.93Å; T344-V350 PolarHBondContact N-O 3.19Å; T344-V350 WeakPolarHBondContact O-CB 3.23Å; T344-V350 PolarHBondContact O-N 3.03Å; T344-K352 HydrophobicContact CG2-CG 3.96Å
345	G	79.4	Confident	79	Confident	30 Å²	30	68 Å²	68	31%	0.309	34%	0.338	S	S	.	.	S	Bend	trans	91.7	157.8	-169.5	0	0	0	0	0	111.9	K347 C348	G345-K347 PolarHBondContact O-N 2.93Å; G345-C348 PolarHBondContact O-N 3.5Å; G345-C348 VanDerWaalsContact O-N 3.09Å
346	W	80.7	Confident	78.2	Confident	170 Å²	170	68.7 Å²	68.7	64%	0.644	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.1	-23.9	-178.6	69.2	-49.1	0	0	0	114.1	C337 E349	C337-W346 PolarHBondContact SG-O 3.06Å; W346-E349 PolarHBondContact NE1-OE1 2.93Å
347	K	82.5	Confident	77.1	Confident	67 Å²	67	69.5 Å²	69.5	29%	0.291	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	-118.8	20.9	175.4	-67.9	-173.1	163.1	-163.5	0	112.4	P321 C322 Y335 G345 E349	P321-K347 WeakPolarHBondContact O-CB 3.46Å; P321-K347 WeakPolarHBondContact O-CD 3.45Å; P321-K347 WeakPolarHBondContact O-CE 3.02Å; P321-K347 WeakPolarHBondContact O-CG 3.38Å; C322-K347 CarbonylContact C-O 3.49Å; Y335-K347 VanDerWaalsContact OH-CE 3.24Å; Y335-K347 WeakPolarHBondContact OH-CE 3.47Å; G345-K347 PolarHBondContact O-N 2.93Å; K347-E349 WeakPolarHBondContact CA-OE2 3.4Å; K347-E349 PolarHBondContact N-OE2 2.84Å; K347-E349 PolarHBondContact O-N 2.91Å
348	C	83.5	Confident	75.8	Confident	2 Å²	2	73.8 Å²	73.8	1%	0.014	37%	0.368	C	S	.	.	S	Bend	trans	54.9	25.8	-178.5	-50.5	0	0	0	0	113.6	H325 C339 Y343 T344 G345	H325-C348 HydrophobicContact CB-CB 4.45Å; H325-C348 VanDerWaalsContact O-CB 3.3Å; H325-C348 WeakPolarHBondContact O-CB 3.05Å; C339-C348 WeakPolarHBondContact CA-SG 3.32Å; C339-C348 HydrophobicContact CB-CB 3.66Å; C339-C348 WeakPolarHBondContact CB-SG 3.42Å; C339-C348 WeakPolarHBondContact SG-CA 3Å; C339-C348 WeakPolarHBondContact SG-CB 3.01Å; C339-C348 CovalentContact SG-SG 2.03Å; C339-C348 PolarHBondContact SG-SG 2.72Å; Y343-C348 WeakPolarHBondContact CD1-O 3.38Å; T344-C348 CarbonylContact O-C 3.46Å; T344-C348 VanDerWaalsContact O-C 3.31Å; T344-C348 VanDerWaalsContact O-CA 3.32Å; T344-C348 WeakPolarHBondContact O-CA 3.44Å; G345-C348 PolarHBondContact O-N 3.5Å; G345-C348 VanDerWaalsContact O-N 3.09Å
349	E	81.2	Confident	74.8	Confident	106 Å²	106	74.8 Å²	74.8	50%	0.495	38%	0.379	S	S	.	.			trans	-85.4	-11.4	-172.5	74.6	-88.6	-129.7	0	0	113.6	T344 W346 K347	T344-E349 PolarHBondContact O-N 2.56Å; W346-E349 PolarHBondContact NE1-OE1 2.93Å; K347-E349 WeakPolarHBondContact CA-OE2 3.4Å; K347-E349 PolarHBondContact N-OE2 2.84Å; K347-E349 PolarHBondContact O-N 2.91Å
350	V	77.1	Confident	74	Confident	69 Å²	69	74 Å²	74	42%	0.418	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	114.2	-175.7	-174	0	0	0	0	109.6	Y343 T344 K352	Y343-V350 CarbonylContact C-O 3.59Å; Y343-V350 WeakPolarHBondContact CA-O 3.32Å; T344-V350 HydrophobicContact CG2-CB 3.83Å; T344-V350 HydrophobicContact CG2-CG1 3.93Å; T344-V350 PolarHBondContact N-O 3.19Å; T344-V350 WeakPolarHBondContact O-CB 3.23Å; T344-V350 PolarHBondContact O-N 3.03Å; V350-K352 PolarHBondContact O-N 2.87Å
351	E	71.4	Confident	73.8	Confident	43 Å²	43	76 Å²	76	20%	0.201	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.3	130.9	168	-174.4	-176.3	-161.9	0	0	109.8	Y343 N353 R369 A373	Y343-E351 HydrophobicContact CE1-CB 4.23Å; E351-N353 PolarHBondContact O-N 3.49Å; E351-R369 WeakPolarHBondContact OE1-CD 3.2Å; E351-R369 IonicContact OE1-NH1 3.79Å; E351-R369 IonicContact OE2-CZ 3.93Å; E351-R369 IonicContact OE2-NH1 2.64Å; E351-R369 PolarHBondContact OE2-NH1 3.36Å; E351-A373 PolarHBondContact OE1-N 3.4Å
352	K	67.3	Low	74.3	Confident	68 Å²	68	67 Å²	67	30%	0.296	34%	0.341	S	S	.	.			trans	-70.6	92.5	175.6	-77.5	173.2	169.2	153	0	109.8	G342 Y343 T344 V350 K354	G342-K352 WeakPolarHBondContact O-CB 3Å; G342-K352 PolarHBondContact O-N 3.32Å; Y343-K352 WeakPolarHBondContact O-CD 3.2Å; Y343-K352 WeakPolarHBondContact O-CE 3.37Å; Y343-K352 PolarHBondContact O-NZ 3.17Å; Y343-K352 VanDerWaalsContact O-NZ 3.09Å; T344-K352 HydrophobicContact CG2-CG 3.96Å; V350-K352 PolarHBondContact O-N 2.87Å; K352-K354 PolarHBondContact O-N 3.18Å
353	N	67.2	Low	75	Confident	52 Å²	52	70.3 Å²	70.3	28%	0.278	36%	0.359	S	S	.	.			trans	-61.9	106.8	170	-177.9	-2.6	0	0	0	110.5	E351 C355 T356 N357 Y375	E351-N353 PolarHBondContact O-N 3.49Å; N353-C355 PolarHBondContact O-N 3.08Å; N353-C355 VanDerWaalsContact OD1-CB 3.24Å; N353-C355 WeakPolarHBondContact OD1-CB 3.47Å; N353-C355 PolarHBondContact OD1-N 3.49Å; N353-C355 PolarHBondContact OD1-SG 2.92Å; N353-C355 VanDerWaalsContact OD1-SG 3.42Å; N353-T356 PolarHBondContact O-N 3Å; N353-T356 VanDerWaalsContact O-N 3.13Å; N353-T356 PolarHBondContact O-OG1 2.84Å; N353-N357 WeakPolarHBondContact O-CB 3.45Å; N353-N357 PolarHBondContact O-N 2.89Å; N353-Y375 WeakPolarHBondContact CA-OH 3.23Å; N353-Y375 VanDerWaalsContact OD1-CE1 3.27Å; N353-Y375 WeakPolarHBondContact OD1-CE1 3.43Å
354	K	69.3	Low	75.3	Confident	58 Å²	58	71.3 Å²	71.3	25%	0.252	37%	0.365	S	S	.	.	H	α-helix	trans	-67.2	-23.8	-176.5	-62.7	-173.4	167.7	154.3	0	113.1	K352 T356 E358 L360 A373 Y375	K352-K354 PolarHBondContact O-N 3.18Å; K354-T356 VanDerWaalsContact C-N 3.25Å; K354-T356 PolarHBondContact O-N 3.08Å; K354-E358 HydrophobicContact CB-CB 4.31Å; K354-E358 VanDerWaalsContact CD-OE2 3.25Å; K354-E358 WeakPolarHBondContact CD-OE2 3.27Å; K354-E358 WeakPolarHBondContact CE-OE2 3.43Å; K354-E358 HydrophobicContact CG-CG 4.34Å; K354-E358 VanDerWaalsContact CG-OE2 3.31Å; K354-E358 WeakPolarHBondContact CG-OE2 3.2Å; K354-E358 PolarHBondContact O-N 3.43Å; K354-L360 WeakPolarHBondContact O-CB 3.08Å; K354-L360 PolarHBondContact O-N 2.97Å; K354-L360 VanDerWaalsContact O-N 3.16Å; K354-A373 PolarHBondContact NZ-O 3.37Å; K354-Y375 HydrophobicContact CB-CD2 3.88Å; K354-Y375 HydrophobicContact CB-CG 3.94Å; K354-Y375 HydrophobicContact CD-CD2 4Å; K354-Y375 HydrophobicContact CG-CD2 3.74Å; K354-Y375 HydrophobicContact CG-CE2 4.32Å; K354-Y375 HydrophobicContact CG-CG 4.3Å
355	C	71.7	Confident	75.8	Confident	38 Å²	38	69.2 Å²	69.2	26%	0.257	35%	0.354	S	S	.	.	H	α-helix	trans	-65.1	-28.2	174.4	-48.3	0	0	0	0	112.7	N353 C367 Y375	N353-C355 PolarHBondContact O-N 3.08Å; N353-C355 VanDerWaalsContact OD1-CB 3.24Å; N353-C355 WeakPolarHBondContact OD1-CB 3.47Å; N353-C355 PolarHBondContact OD1-N 3.49Å; N353-C355 PolarHBondContact OD1-SG 2.92Å; N353-C355 VanDerWaalsContact OD1-SG 3.42Å; C355-C367 WeakPolarHBondContact CA-SG 3.47Å; C355-C367 HydrophobicContact CB-CB 3.68Å; C355-C367 WeakPolarHBondContact CB-SG 3.46Å; C355-C367 WeakPolarHBondContact SG-CB 3.2Å; C355-C367 CovalentContact SG-SG 2.03Å; C355-C367 PolarHBondContact SG-SG 2.75Å; C355-Y375 VanDerWaalsContact SG-CD1 3.55Å
356	T	68.1	Low	76.2	Confident	84 Å²	84	72.9 Å²	72.9	52%	0.515	36%	0.364	S	S	.	.	H	α-helix	trans	-112.9	-32.2	-177.5	57.3	0	0	0	0	113.9	N353 K354	N353-T356 PolarHBondContact O-N 3Å; N353-T356 VanDerWaalsContact O-N 3.13Å; N353-T356 PolarHBondContact O-OG1 2.84Å; K354-T356 VanDerWaalsContact C-N 3.25Å; K354-T356 PolarHBondContact O-N 3.08Å
357	N	63.1	Low	76.6	Confident	90 Å²	90	66.6 Å²	66.6	48%	0.481	35%	0.346	S	S	.	.	H	α-helix	trans	-103.3	-23	-168.4	-59.7	3.5	0	0	0	113.1	N353	N353-N357 WeakPolarHBondContact O-CB 3.45Å; N353-N357 PolarHBondContact O-N 2.89Å
358	E	63.2	Low	76.7	Confident	115 Å²	115	67.5 Å²	67.5	54%	0.537	35%	0.352	S	S	.	.	S	Bend	trans	-113.8	10.2	177.9	-63.5	-174	173	0	0	112	K354 L360	K354-E358 HydrophobicContact CB-CB 4.31Å; K354-E358 VanDerWaalsContact CD-OE2 3.25Å; K354-E358 WeakPolarHBondContact CD-OE2 3.27Å; K354-E358 WeakPolarHBondContact CE-OE2 3.43Å; K354-E358 HydrophobicContact CG-CG 4.34Å; K354-E358 VanDerWaalsContact CG-OE2 3.31Å; K354-E358 WeakPolarHBondContact CG-OE2 3.2Å; K354-E358 PolarHBondContact O-N 3.43Å; E358-L360 VanDerWaalsContact C-N 3.33Å; E358-L360 PolarHBondContact O-N 2.82Å
359	N	65.6	Low	76.6	Confident	136 Å²	136	73.6 Å²	73.6	73%	0.727	38%	0.375	S	S	*	.			trans	48.9	46.5	-178.5	-70	-19.3	0	0	0	113.8	H361	N359-H361 PolarHBondContact O-N 2.97Å
360	L	71.3	Confident	76.6	Confident	29 Å²	29	72.1 Å²	72.1	15%	0.152	37%	0.373	C	S	.	.			trans	-70.7	77.5	173.2	-174	59.1	0	0	0	110.9	K354 E358 C362 L387	K354-L360 WeakPolarHBondContact O-CB 3.08Å; K354-L360 PolarHBondContact O-N 2.97Å; K354-L360 VanDerWaalsContact O-N 3.16Å; E358-L360 VanDerWaalsContact C-N 3.33Å; E358-L360 PolarHBondContact O-N 2.82Å; L360-C362 PolarHBondContact O-N 3.05Å; L360-L387 HydrophobicContact CD1-CD2 3.53Å
361	H	81.5	Confident	76.4	Confident	142 Å²	142	75 Å²	75	66%	0.657	38%	0.38	S	S	*	.			trans	-83.2	97	-177.3	-174.3	-68.3	0	0	0	111.1	N359	N359-H361 PolarHBondContact O-N 2.97Å
362	C	85.9	Confident	76.2	Confident	14 Å²	14	80 Å²	80	10%	0.095	40%	0.403	C	S	.	.			trans	-67.3	128.7	167.4	-46.7	0	0	0	0	109.4	L360 G365 C377 L387	L360-C362 PolarHBondContact O-N 3.05Å; C362-G365 WeakPolarHBondContact CB-O 3.4Å; C362-C377 VanDerWaalsContact CA-SG 3.55Å; C362-C377 HydrophobicContact CB-CB 3.78Å; C362-C377 WeakPolarHBondContact CB-SG 3.3Å; C362-C377 VanDerWaalsContact SG-CA 3.52Å; C362-C377 WeakPolarHBondContact SG-CB 3.42Å; C362-C377 CovalentContact SG-SG 2.03Å; C362-C377 PolarHBondContact SG-SG 2.91Å; C362-L387 CarbonylContact C-O 3.26Å; C362-L387 VanDerWaalsContact CA-O 3.31Å; C362-L387 WeakPolarHBondContact CA-O 3.34Å
363	V	87.2	Confident	76.1	Confident	74 Å²	74	77.9 Å²	77.9	45%	0.448	40%	0.399	S	S	.	.	S	Bend	trans	-77.4	-55.2	-177.8	-172.6	0	0	0	0	110.2	L387 D389	V363-L387 PolarHBondContact N-O 3.47Å; V363-D389 HydrophobicContact CG2-CB 4.07Å
364	H	87.2	Confident	76.4	Confident	56 Å²	56	79.5 Å²	79.5	26%	0.259	41%	0.405	S	S	.	.	S	Bend	trans	-120.7	58.3	176.1	-50.3	109.1	0	0	0	111.3	Y380 Y383 C388	H364-Y380 HydrophobicContact CB-CD2 4.09Å; H364-Y380 WeakPolarHBondContact O-CD2 3.39Å; H364-Y380 PolarHBondContact O-N 2.7Å; H364-Y383 HydrophobicContact CB-CD1 3.93Å; H364-Y383 HydrophobicContact CB-CD2 3.42Å; H364-Y383 VanDerWaalsContact CB-CD2 3.42Å; H364-Y383 HydrophobicContact CB-CE1 4.26Å; H364-Y383 HydrophobicContact CB-CE2 3.79Å; H364-Y383 HydrophobicContact CB-CG 3.48Å; H364-Y383 VanDerWaalsContact CB-CG 3.48Å; H364-Y383 AromaticContact CD2-CZ 3.91Å; H364-Y383 AromaticContact CE1-CE1 3.49Å; H364-Y383 VanDerWaalsContact CE1-CE1 3.49Å; H364-Y383 WeakPolarHBondContact CE1-CE1 3.31Å; H364-Y383 AromaticContact CE1-CZ 3.82Å; H364-Y383 AromaticContact CG-CD1 3.77Å; H364-Y383 AromaticContact CG-CD2 3.86Å; H364-Y383 AromaticContact CG-CE1 3.69Å; H364-Y383 AromaticContact CG-CE2 3.77Å; H364-Y383 AromaticContact CG-CG 3.85Å; H364-Y383 AromaticContact CG-CZ 3.67Å; H364-Y383 AromaticContact ND1-CD1 3.3Å; H364-Y383 VanDerWaalsContact ND1-CD1 3.3Å; H364-Y383 WeakPolarHBondContact ND1-CD1 3.38Å; H364-Y383 AromaticContact ND1-CE1 3.19Å; H364-Y383 WeakPolarHBondContact ND1-CE1 3.18Å; H364-Y383 AromaticContact ND1-CG 3.83Å; H364-Y383 AromaticContact ND1-CZ 3.64Å; H364-C388 VanDerWaalsContact C-CB 3.43Å; H364-C388 HydrophobicContact CB-CB 4.28Å; H364-C388 WeakPolarHBondContact CB-O 3.17Å; H364-C388 PolarHBondContact N-O 3.07Å; H364-C388 VanDerWaalsContact N-O 3.15Å; H364-C388 PolarHBondContact ND1-O 2.99Å; H364-C388 WeakPolarHBondContact O-CB 3.27Å
365	G	87.8	Confident	77	Confident	10 Å²	10	78.5 Å²	78.5	10%	0.103	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-172.9	-179.5	179.1	0	0	0	0	0	113.5	C362 D378	C362-G365 WeakPolarHBondContact CB-O 3.4Å; G365-D378 CarbonylContact C-O 3.58Å; G365-D378 WeakPolarHBondContact CA-O 3.46Å
366	M	88.1	Confident	77.6	Confident	108 Å²	108	82.5 Å²	82.5	53%	0.532	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	137.6	176.7	66.1	-178.2	81	0	0	111.8	C377 D378 Y380	M366-C377 WeakPolarHBondContact O-CA 3.44Å; M366-D378 HydrophobicContact CG-CB 4.06Å; M366-D378 PolarHBondContact N-O 2.96Å; M366-D378 PolarHBondContact O-N 2.81Å; M366-Y380 HydrophobicContact CE-CE1 4.27Å
367	C	87.5	Confident	78.6	Confident	38 Å²	38	78.6 Å²	78.6	26%	0.257	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	120.3	177.9	-179	0	0	0	0	110.5	C355	C355-C367 WeakPolarHBondContact CA-SG 3.47Å; C355-C367 HydrophobicContact CB-CB 3.68Å; C355-C367 WeakPolarHBondContact CB-SG 3.46Å; C355-C367 WeakPolarHBondContact SG-CB 3.2Å; C355-C367 CovalentContact SG-SG 2.03Å; C355-C367 PolarHBondContact SG-SG 2.75Å
368	M	85.6	Confident	79.9	Confident	85 Å²	85	78.1 Å²	78.1	42%	0.419	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	153.9	-178.6	68.2	171.9	-64.1	0	0	112.7	Y375 K376 D378	M368-Y375 VanDerWaalsContact O-CA 3.29Å; M368-Y375 WeakPolarHBondContact O-CA 3.34Å; M368-K376 PolarHBondContact N-O 2.04Å; M368-K376 PolarHBondContact O-N 2.89Å; M368-D378 HydrophobicContact CG-CB 4.29Å; M368-D378 HydrophobicContact SD-CB 3.85Å
369	R	81.3	Confident	81.3	Confident	130 Å²	130	74.4 Å²	74.4	49%	0.491	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	124.7	172.3	-165.8	178.9	69.8	164.8	8.8	109.8	E351 K371 Y375	E351-R369 WeakPolarHBondContact OE1-CD 3.2Å; E351-R369 IonicContact OE1-NH1 3.79Å; E351-R369 IonicContact OE2-CZ 3.93Å; E351-R369 IonicContact OE2-NH1 2.64Å; E351-R369 PolarHBondContact OE2-NH1 3.36Å; R369-K371 WeakPolarHBondContact CG-O 3.32Å; R369-Y375 HydrophobicContact CB-CD1 3.91Å; R369-Y375 HydrophobicContact CB-CE1 3.61Å; R369-Y375 HydrophobicContact CG-CD1 4.3Å; R369-Y375 HydrophobicContact CG-CD2 4.48Å; R369-Y375 HydrophobicContact CG-CE1 3.93Å; R369-Y375 HydrophobicContact CG-CE2 4.11Å
370	V	81.2	Confident	82.5	Confident	75 Å²	75	73.8 Å²	73.8	46%	0.455	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	-42.5	178.9	-175.2	0	0	0	0	110.8	E374 K376	V370-E374 HydrophobicContact CB-CG 4.37Å; V370-E374 PolarHBondContact N-O 2.83Å; V370-K376 HydrophobicContact CG2-CB 3.65Å
371	K	73.3	Confident	83.3	Confident	129 Å²	129	79 Å²	79	56%	0.561	39%	0.394	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-146	176.5	171.6	-54.4	-170.8	-157.1	82.5	0	109.2	R369 A373 E374	R369-K371 WeakPolarHBondContact CG-O 3.32Å; K371-A373 PolarHBondContact O-N 3.45Å; K371-E374 HydrophobicContact CB-CB 4.02Å; K371-E374 WeakPolarHBondContact CD-OE2 3.11Å; K371-E374 VanDerWaalsContact CG-OE2 3.25Å; K371-E374 WeakPolarHBondContact CG-OE2 3.39Å; K371-E374 PolarHBondContact N-O 2.87Å; K371-E374 IonicContact NZ-OE1 3.93Å; K371-E374 IonicContact NZ-OE2 2.72Å; K371-E374 PolarHBondContact NZ-OE2 2.98Å; K371-E374 PolarHBondContact O-N 3.31Å; K371-E374 VanDerWaalsContact O-O 3.1Å
372	E	65.9	Low	83.6	Confident	149 Å²	149	72.6 Å²	72.6	70%	0.696	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53	129	171.5	-67.1	169.8	165.8	0	0	110.5	E374	E372-E374 PolarHBondContact O-N 2.73Å
373	A	65.8	Low	83.9	Confident	24 Å²	24	73.5 Å²	73.5	20%	0.198	37%	0.368	C	S	.	.	T	Hydrogen-bonded Turn	trans	55.8	1.5	-170.5	0	0	0	0	0	117.3	E351 K354 K371	E351-A373 PolarHBondContact OE1-N 3.4Å; K354-A373 PolarHBondContact NZ-O 3.37Å; K371-A373 PolarHBondContact O-N 3.45Å
374	E	74.7	Confident	84.1	Confident	86 Å²	86	73.1 Å²	73.1	40%	0.402	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	113.4	-179.2	-170	-179.4	-156.1	0	0	111.2	V370 K371 E372	V370-E374 HydrophobicContact CB-CG 4.37Å; V370-E374 PolarHBondContact N-O 2.83Å; K371-E374 HydrophobicContact CB-CB 4.02Å; K371-E374 WeakPolarHBondContact CD-OE2 3.11Å; K371-E374 VanDerWaalsContact CG-OE2 3.25Å; K371-E374 WeakPolarHBondContact CG-OE2 3.39Å; K371-E374 PolarHBondContact N-O 2.87Å; K371-E374 IonicContact NZ-OE1 3.93Å; K371-E374 IonicContact NZ-OE2 2.72Å; K371-E374 PolarHBondContact NZ-OE2 2.98Å; K371-E374 PolarHBondContact O-N 3.31Å; K371-E374 VanDerWaalsContact O-O 3.1Å; E372-E374 PolarHBondContact O-N 2.73Å
375	Y	80	Confident	84.1	Confident	36 Å²	36	71.7 Å²	71.7	14%	0.141	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	142.8	-178.8	-69.6	-100.5	0	0	0	110.4	N353 K354 C355 M368 R369	N353-Y375 WeakPolarHBondContact CA-OH 3.23Å; N353-Y375 VanDerWaalsContact OD1-CE1 3.27Å; N353-Y375 WeakPolarHBondContact OD1-CE1 3.43Å; K354-Y375 HydrophobicContact CB-CD2 3.88Å; K354-Y375 HydrophobicContact CB-CG 3.94Å; K354-Y375 HydrophobicContact CD-CD2 4Å; K354-Y375 HydrophobicContact CG-CD2 3.74Å; K354-Y375 HydrophobicContact CG-CE2 4.32Å; K354-Y375 HydrophobicContact CG-CG 4.3Å; C355-Y375 VanDerWaalsContact SG-CD1 3.55Å; M368-Y375 VanDerWaalsContact O-CA 3.29Å; M368-Y375 WeakPolarHBondContact O-CA 3.34Å; R369-Y375 HydrophobicContact CB-CD1 3.91Å; R369-Y375 HydrophobicContact CB-CE1 3.61Å; R369-Y375 HydrophobicContact CG-CD1 4.3Å; R369-Y375 HydrophobicContact CG-CD2 4.48Å; R369-Y375 HydrophobicContact CG-CE1 3.93Å; R369-Y375 HydrophobicContact CG-CE2 4.11Å
376	K	85.9	Confident	84.1	Confident	122 Å²	122	81 Å²	81	53%	0.53	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	151.1	-179.8	-164.5	-150	166.5	-157.9	0	109.5	M368 V370	M368-K376 PolarHBondContact N-O 2.04Å; M368-K376 PolarHBondContact O-N 2.89Å; V370-K376 HydrophobicContact CG2-CB 3.65Å
377	C	89.2	Confident	84.1	Confident	3 Å²	3	78.7 Å²	78.7	2%	0.02	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	132.8	161.7	-61.6	0	0	0	0	110.5	C362 M366 C388	C362-C377 VanDerWaalsContact CA-SG 3.55Å; C362-C377 HydrophobicContact CB-CB 3.78Å; C362-C377 WeakPolarHBondContact CB-SG 3.3Å; C362-C377 VanDerWaalsContact SG-CA 3.52Å; C362-C377 WeakPolarHBondContact SG-CB 3.42Å; C362-C377 CovalentContact SG-SG 2.03Å; C362-C377 PolarHBondContact SG-SG 2.91Å; M366-C377 WeakPolarHBondContact O-CA 3.44Å; C377-C388 WeakPolarHBondContact CB-SG 3.24Å
378	D	90.6	Very high	84.2	Confident	80 Å²	80	76.9 Å²	76.9	43%	0.428	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	116.1	163.2	-166.7	35.7	0	0	0	107.7	G365 M366 M368	G365-D378 CarbonylContact C-O 3.58Å; G365-D378 WeakPolarHBondContact CA-O 3.46Å; M366-D378 HydrophobicContact CG-CB 4.06Å; M366-D378 PolarHBondContact N-O 2.96Å; M366-D378 PolarHBondContact O-N 2.81Å; M368-D378 HydrophobicContact CG-CB 4.29Å; M368-D378 HydrophobicContact SD-CB 3.85Å
379	C	91.8	Very high	84.5	Confident	36 Å²	36	76.8 Å²	76.8	24%	0.243	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	144.1	-167.3	-58.9	0	0	0	0	112	Y383 C388	C379-Y383 WeakPolarHBondContact CB-O 3.4Å; C379-C388 WeakPolarHBondContact CA-SG 3.29Å; C379-C388 HydrophobicContact CB-CB 3.7Å; C379-C388 WeakPolarHBondContact CB-SG 3.42Å; C379-C388 VanDerWaalsContact SG-CA 3.51Å; C379-C388 WeakPolarHBondContact SG-CB 3.26Å; C379-C388 CovalentContact SG-SG 2.04Å; C379-C388 PolarHBondContact SG-SG 2.96Å
380	Y	91.6	Very high	84.9	Confident	123 Å²	123	75.9 Å²	75.9	48%	0.482	38%	0.378	S	S	.	.	P	Polyproline II helix	trans	-64.8	151.4	168.8	-55	-34.4	0	0	0	110	H364 M366 G382 Y383	H364-Y380 HydrophobicContact CB-CD2 4.09Å; H364-Y380 WeakPolarHBondContact O-CD2 3.39Å; H364-Y380 PolarHBondContact O-N 2.7Å; M366-Y380 HydrophobicContact CE-CE1 4.27Å; Y380-G382 PolarHBondContact O-N 3.35Å; Y380-Y383 PolarHBondContact O-N 3.43Å; Y380-Y383 VanDerWaalsContact O-N 3.08Å
381	T	87.6	Confident	85.4	Confident	139 Å²	139	75.1 Å²	75.1	85%	0.853	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.6	131.7	173.8	47.8	0	0	0	0	110.5
382	G	87.3	Confident	86.2	Confident	7 Å²	7	71.8 Å²	71.8	7%	0.072	36%	0.359	C	S	.	.	T	Hydrogen-bonded Turn	trans	97.7	-8.2	-172.9	0	0	0	0	0	114.8	Y380 I392	Y380-G382 PolarHBondContact O-N 3.35Å; G382-I392 WeakPolarHBondContact O-CB 3.42Å; G382-I392 WeakPolarHBondContact O-CG1 3.47Å; G382-I392 PolarHBondContact O-N 3.45Å
383	Y	92.9	Very high	87.4	Confident	34 Å²	34	69.2 Å²	69.2	13%	0.133	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	147.1	-176.5	-63.6	-79.9	0	0	0	114.7	H364 C379 Y380 E390 N411 G412	H364-Y383 HydrophobicContact CB-CD1 3.93Å; H364-Y383 HydrophobicContact CB-CD2 3.42Å; H364-Y383 VanDerWaalsContact CB-CD2 3.42Å; H364-Y383 HydrophobicContact CB-CE1 4.26Å; H364-Y383 HydrophobicContact CB-CE2 3.79Å; H364-Y383 HydrophobicContact CB-CG 3.48Å; H364-Y383 VanDerWaalsContact CB-CG 3.48Å; H364-Y383 AromaticContact CD2-CZ 3.91Å; H364-Y383 AromaticContact CE1-CE1 3.49Å; H364-Y383 VanDerWaalsContact CE1-CE1 3.49Å; H364-Y383 WeakPolarHBondContact CE1-CE1 3.31Å; H364-Y383 AromaticContact CE1-CZ 3.82Å; H364-Y383 AromaticContact CG-CD1 3.77Å; H364-Y383 AromaticContact CG-CD2 3.86Å; H364-Y383 AromaticContact CG-CE1 3.69Å; H364-Y383 AromaticContact CG-CE2 3.77Å; H364-Y383 AromaticContact CG-CG 3.85Å; H364-Y383 AromaticContact CG-CZ 3.67Å; H364-Y383 AromaticContact ND1-CD1 3.3Å; H364-Y383 VanDerWaalsContact ND1-CD1 3.3Å; H364-Y383 WeakPolarHBondContact ND1-CD1 3.38Å; H364-Y383 AromaticContact ND1-CE1 3.19Å; H364-Y383 WeakPolarHBondContact ND1-CE1 3.18Å; H364-Y383 AromaticContact ND1-CG 3.83Å; H364-Y383 AromaticContact ND1-CZ 3.64Å; C379-Y383 WeakPolarHBondContact CB-O 3.4Å; Y380-Y383 PolarHBondContact O-N 3.43Å; Y380-Y383 VanDerWaalsContact O-N 3.08Å; Y383-E390 WeakPolarHBondContact CA-O 3.45Å; Y383-N411 PolarHBondContact OH-ND2 2.98Å; Y383-N411 PolarHBondContact OH-O 2.95Å; Y383-G412 WeakPolarHBondContact OH-CA 3.28Å; Y383-G412 PolarHBondContact OH-N 2.88Å
384	T	89.9	Confident	88.6	Confident	66 Å²	66	69.9 Å²	69.9	41%	0.405	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	-168.2	-178.4	-168.8	0	0	0	0	110.9	C388 D389 E390 I392	T384-C388 CarbonylContact O-C 3.53Å; T384-C388 WeakPolarHBondContact O-CA 3.02Å; T384-D389 PolarHBondContact O-N 2.81Å; T384-E390 HydrophobicContact CG2-CB 3.68Å; T384-E390 PolarHBondContact N-O 2.03Å; T384-E390 PolarHBondContact O-N 2.85Å; T384-I392 HydrophobicContact CG2-CG1 3.86Å
385	G	88.6	Confident	89.4	Confident	25 Å²	25	67 Å²	67	26%	0.258	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	87.2	-174.4	-174.9	0	0	0	0	0	113.1	E390	G385-E390 WeakPolarHBondContact CA-OE2 3.45Å; G385-E390 PolarHBondContact N-OE2 3.43Å
386	R	87.2	Confident	89.8	Confident	206 Å²	206	69.2 Å²	69.2	78%	0.777	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.4	-29.9	-177.4	178.9	174.4	169.8	-171.2	-5.7	112.5
387	L	88.1	Confident	89.8	Confident	59 Å²	59	67.3 Å²	67.3	31%	0.309	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113.5	11.6	-177.3	-55.2	175	0	0	0	111.9	L360 C362 V363 D389	L360-L387 HydrophobicContact CD1-CD2 3.53Å; C362-L387 CarbonylContact C-O 3.26Å; C362-L387 VanDerWaalsContact CA-O 3.31Å; C362-L387 WeakPolarHBondContact CA-O 3.34Å; V363-L387 PolarHBondContact N-O 3.47Å; L387-D389 WeakPolarHBondContact CA-OD1 3.34Å; L387-D389 HydrophobicContact CB-CB 4.17Å; L387-D389 WeakPolarHBondContact CB-OD1 3.06Å; L387-D389 PolarHBondContact N-OD1 2.78Å; L387-D389 PolarHBondContact O-N 3.42Å
388	C	90.5	Very high	89.3	Confident	0 Å²	0	73.4 Å²	73.4	0%	0	40%	0.396	C	S	.	.	T	Hydrogen-bonded Turn	trans	58.2	39.8	-171.7	-44.6	0	0	0	0	111.5	H364 C377 C379 T384	H364-C388 VanDerWaalsContact C-CB 3.43Å; H364-C388 HydrophobicContact CB-CB 4.28Å; H364-C388 WeakPolarHBondContact CB-O 3.17Å; H364-C388 PolarHBondContact N-O 3.07Å; H364-C388 VanDerWaalsContact N-O 3.15Å; H364-C388 PolarHBondContact ND1-O 2.99Å; H364-C388 WeakPolarHBondContact O-CB 3.27Å; C377-C388 WeakPolarHBondContact CB-SG 3.24Å; C379-C388 WeakPolarHBondContact CA-SG 3.29Å; C379-C388 HydrophobicContact CB-CB 3.7Å; C379-C388 WeakPolarHBondContact CB-SG 3.42Å; C379-C388 VanDerWaalsContact SG-CA 3.51Å; C379-C388 WeakPolarHBondContact SG-CB 3.26Å; C379-C388 CovalentContact SG-SG 2.04Å; C379-C388 PolarHBondContact SG-SG 2.96Å; T384-C388 CarbonylContact O-C 3.53Å; T384-C388 WeakPolarHBondContact O-CA 3.02Å
389	D	90.3	Very high	89	Confident	84 Å²	84	73.3 Å²	73.3	45%	0.449	40%	0.402	S	S	.	.			trans	-106.2	-13	-172.8	52.8	-43.4	0	0	0	112.8	V363 T384 L387	V363-D389 HydrophobicContact CG2-CB 4.07Å; T384-D389 PolarHBondContact O-N 2.81Å; L387-D389 WeakPolarHBondContact CA-OD1 3.34Å; L387-D389 HydrophobicContact CB-CB 4.17Å; L387-D389 WeakPolarHBondContact CB-OD1 3.06Å; L387-D389 PolarHBondContact N-OD1 2.78Å; L387-D389 PolarHBondContact O-N 3.42Å
390	E	91	Very high	88.8	Confident	110 Å²	110	72.6 Å²	72.6	51%	0.514	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	129	175.7	-62.7	173.8	165.6	0	0	110.1	Y383 T384 G385	Y383-E390 WeakPolarHBondContact CA-O 3.45Å; T384-E390 HydrophobicContact CG2-CB 3.68Å; T384-E390 PolarHBondContact N-O 2.03Å; T384-E390 PolarHBondContact O-N 2.85Å; G385-E390 WeakPolarHBondContact CA-OE2 3.45Å; G385-E390 PolarHBondContact N-OE2 3.43Å
391	D	91.7	Very high	88.6	Confident	59 Å²	59	66.9 Å²	66.9	32%	0.316	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	134.1	171.8	-175.9	41.2	0	0	0	110.2	N393 N409 N411 G412	D391-N393 PolarHBondContact O-N 3.19Å; D391-N409 PolarHBondContact OD2-ND2 3.26Å; D391-N411 WeakPolarHBondContact OD1-CA 3.49Å; D391-G412 PolarHBondContact OD1-N 3.26Å
392	I	90.8	Very high	88.5	Confident	60 Å²	60	61.9 Å²	61.9	31%	0.308	35%	0.35	S	S	.	.	P	Polyproline II helix	trans	-77.3	118.9	173.9	-65.8	176.6	0	0	0	108.3	G382 T384 E394 N409	G382-I392 WeakPolarHBondContact O-CB 3.42Å; G382-I392 WeakPolarHBondContact O-CG1 3.47Å; G382-I392 PolarHBondContact O-N 3.45Å; T384-I392 HydrophobicContact CG2-CG1 3.86Å; I392-E394 VanDerWaalsContact C-N 3.28Å; I392-E394 HydrophobicContact CG2-CG 3.95Å; I392-E394 PolarHBondContact O-N 2.8Å; I392-N409 PolarHBondContact O-ND2 2.03Å; I392-N409 PolarHBondContact O-OD1 3.37Å
393	N	90.4	Very high	88.2	Confident	94 Å²	94	73.2 Å²	73.2	50%	0.503	39%	0.391	S	S	.	.			trans	-77.5	80	168.5	-174.6	10	0	0	0	110.1	D391 C395 A396 N409	D391-N393 PolarHBondContact O-N 3.19Å; N393-C395 PolarHBondContact O-N 2.79Å; N393-C395 PolarHBondContact OD1-N 2.64Å; N393-A396 VanDerWaalsContact O-CB 3.27Å; N393-A396 WeakPolarHBondContact O-CB 3.01Å; N393-A396 PolarHBondContact O-N 3.1Å; N393-A396 VanDerWaalsContact O-N 3.09Å; N393-N409 WeakPolarHBondContact CA-OD1 3.11Å; N393-N409 PolarHBondContact OD1-OD1 2.95Å
394	E	90.5	Very high	87.8	Confident	38 Å²	38	73.1 Å²	73.1	18%	0.178	39%	0.393	C	S	.	.	G	3₁₀ helix	trans	-57.8	-34.7	177.4	-75.2	106.8	-158.7	0	0	111.3	I392 A396 D397 I400 N409 S413 F414	I392-E394 VanDerWaalsContact C-N 3.28Å; I392-E394 HydrophobicContact CG2-CG 3.95Å; I392-E394 PolarHBondContact O-N 2.8Å; E394-A396 PolarHBondContact O-N 2.89Å; E394-D397 PolarHBondContact O-N 3.29Å; E394-I400 HydrophobicContact CB-CD1 3.73Å; E394-I400 VanDerWaalsContact O-CD1 3.24Å; E394-I400 WeakPolarHBondContact O-CD1 3.24Å; E394-N409 PolarHBondContact N-OD1 3.03Å; E394-S413 VanDerWaalsContact OE2-C 3.3Å; E394-S413 WeakPolarHBondContact OE2-CA 3.49Å; E394-F414 HydrophobicContact CB-CB 4.12Å; E394-F414 HydrophobicContact CB-CD1 3.85Å; E394-F414 HydrophobicContact CB-CG 4.34Å; E394-F414 HydrophobicContact CG-CD1 4.04Å; E394-F414 PolarHBondContact OE2-N 2.71Å
395	C	91.1	Very high	87.8	Confident	27 Å²	27	71 Å²	71	18%	0.182	38%	0.384	C	S	.	.	G	3₁₀ helix	trans	-65	3.1	176.7	-59.3	0	0	0	0	115.2	N393 C407 R408 N409	N393-C395 PolarHBondContact O-N 2.79Å; N393-C395 PolarHBondContact OD1-N 2.64Å; C395-C407 WeakPolarHBondContact CA-SG 3.27Å; C395-C407 HydrophobicContact CB-CB 3.67Å; C395-C407 WeakPolarHBondContact CB-SG 3.4Å; C395-C407 WeakPolarHBondContact SG-CB 3.46Å; C395-C407 CovalentContact SG-SG 2.04Å; C395-C407 PolarHBondContact SG-SG 2.76Å; C395-R408 PolarHBondContact SG-N 3.45Å; C395-N409 PolarHBondContact SG-N 2.84Å; C395-N409 VanDerWaalsContact SG-N 3.44Å
396	A	88.6	Confident	87.9	Confident	82 Å²	82	76.6 Å²	76.6	68%	0.678	40%	0.403	S	S	*	.	G	3₁₀ helix	trans	-66.6	-24.5	161.1	0	0	0	0	0	112.7	N393 E394	N393-A396 VanDerWaalsContact O-CB 3.27Å; N393-A396 WeakPolarHBondContact O-CB 3.01Å; N393-A396 PolarHBondContact O-N 3.1Å; N393-A396 VanDerWaalsContact O-N 3.09Å; E394-A396 PolarHBondContact O-N 2.89Å
397	D	85.7	Confident	88.2	Confident	82 Å²	82	68 Å²	68	44%	0.439	37%	0.374	S	S	.	.	S	Bend	trans	-91.6	108.7	166.8	-174.2	-18.5	0	0	0	109.9	E394 S399 I400	E394-D397 PolarHBondContact O-N 3.29Å; D397-S399 VanDerWaalsContact CG-OG 3.31Å; D397-S399 PolarHBondContact O-N 2.96Å; D397-S399 VanDerWaalsContact OD1-CB 3.3Å; D397-S399 WeakPolarHBondContact OD1-CB 3.03Å; D397-S399 PolarHBondContact OD1-N 2.92Å; D397-S399 PolarHBondContact OD1-OG 3.18Å; D397-S399 PolarHBondContact OD2-OG 3.24Å; D397-I400 HydrophobicContact CB-CD1 4.11Å; D397-I400 HydrophobicContact CB-CG1 4.1Å; D397-I400 PolarHBondContact O-N 3.33Å
398	T	80.1	Confident	88.4	Confident	130 Å²	130	70.9 Å²	70.9	80%	0.798	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.3	-4	-178.3	56.5	0	0	0	0	114.2
399	S	83.8	Confident	88.4	Confident	78 Å²	78	73 Å²	73	55%	0.545	39%	0.392	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.9	-10.3	177.3	71.8	0	0	0	0	114.2	D397 C401 G402	D397-S399 VanDerWaalsContact CG-OG 3.31Å; D397-S399 PolarHBondContact O-N 2.96Å; D397-S399 VanDerWaalsContact OD1-CB 3.3Å; D397-S399 WeakPolarHBondContact OD1-CB 3.03Å; D397-S399 PolarHBondContact OD1-N 2.92Å; D397-S399 PolarHBondContact OD1-OG 3.18Å; D397-S399 PolarHBondContact OD2-OG 3.24Å; S399-C401 PolarHBondContact O-N 3.36Å; S399-G402 PolarHBondContact O-N 3.17Å; S399-G402 VanDerWaalsContact O-N 3.14Å
400	I	87.6	Confident	88.4	Confident	21 Å²	21	72.3 Å²	72.3	11%	0.108	39%	0.391	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-35.6	-168.7	-81.6	-174.4	0	0	0	114.7	E394 D397 F414 R426	E394-I400 HydrophobicContact CB-CD1 3.73Å; E394-I400 VanDerWaalsContact O-CD1 3.24Å; E394-I400 WeakPolarHBondContact O-CD1 3.24Å; D397-I400 HydrophobicContact CB-CD1 4.11Å; D397-I400 HydrophobicContact CB-CG1 4.1Å; D397-I400 PolarHBondContact O-N 3.33Å; I400-F414 HydrophobicContact CG2-CD1 4.18Å; I400-F414 HydrophobicContact CG2-CD2 3.45Å; I400-F414 VanDerWaalsContact CG2-CD2 3.45Å; I400-F414 HydrophobicContact CG2-CE1 4.21Å; I400-F414 HydrophobicContact CG2-CE2 3.49Å; I400-F414 VanDerWaalsContact CG2-CE2 3.49Å; I400-F414 HydrophobicContact CG2-CG 3.84Å; I400-F414 HydrophobicContact CG2-CZ 3.9Å; I400-R426 WeakPolarHBondContact O-CB 3.16Å; I400-R426 WeakPolarHBondContact O-CG 3.08Å; I400-R426 PolarHBondContact O-NH1 3.4Å
401	C	88	Confident	88.4	Confident	3 Å²	3	72.2 Å²	72.2	2%	0.02	39%	0.394	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.4	25.2	179.5	-57.5	0	0	0	0	112.7	S399 G405 C407 C416 R426	S399-C401 PolarHBondContact O-N 3.36Å; C401-G405 WeakPolarHBondContact CB-O 3.08Å; C401-G405 PolarHBondContact O-N 2.66Å; C401-C407 WeakPolarHBondContact SG-CA 3.05Å; C401-C407 VanDerWaalsContact SG-CB 3.5Å; C401-C416 WeakPolarHBondContact CA-SG 3.42Å; C401-C416 HydrophobicContact CB-CB 3.72Å; C401-C416 WeakPolarHBondContact CB-SG 3.06Å; C401-C416 VanDerWaalsContact SG-CA 3.51Å; C401-C416 WeakPolarHBondContact SG-CB 3.24Å; C401-C416 CovalentContact SG-SG 2.03Å; C401-C416 PolarHBondContact SG-SG 3.31Å; C401-R426 CarbonylContact C-O 2.84Å; C401-R426 VanDerWaalsContact CA-O 3.31Å; C401-R426 WeakPolarHBondContact CA-O 3.47Å; C401-R426 VanDerWaalsContact O-O 3.12Å
402	G	83.8	Confident	88.1	Confident	35 Å²	35	70.4 Å²	70.4	36%	0.361	39%	0.389	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.9	-143.6	-175	0	0	0	0	0	112.2	S399	S399-G402 PolarHBondContact O-N 3.17Å; S399-G402 VanDerWaalsContact O-N 3.14Å
403	W	82.8	Confident	88	Confident	244 Å²	244	70.5 Å²	70.5	92%	0.924	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.1	-5.1	172.4	-73.1	29.6	0	0	0	112.1
404	N	84.4	Confident	88.1	Confident	33 Å²	33	67.9 Å²	67.9	18%	0.176	38%	0.379	C	S	.	.	S	Bend	trans	-105.9	22.2	-174.8	-46.6	-55.3	0	0	0	112.4	C418 E419 F422 C427 R449	N404-C418 CarbonylContact O-C 3.57Å; N404-C418 WeakPolarHBondContact O-CA 3.34Å; N404-E419 PolarHBondContact O-N 3.33Å; N404-F422 HydrophobicContact CB-CB 4.05Å; N404-F422 HydrophobicContact CB-CD1 3.88Å; N404-F422 HydrophobicContact CB-CD2 3.62Å; N404-F422 HydrophobicContact CB-CE1 4.32Å; N404-F422 HydrophobicContact CB-CE2 4.09Å; N404-F422 HydrophobicContact CB-CG 3.52Å; N404-F422 HydrophobicContact CB-CZ 4.42Å; N404-F422 VanDerWaalsContact ND2-CD1 3.32Å; N404-F422 WeakPolarHBondContact ND2-CD1 3.45Å; N404-F422 WeakPolarHBondContact ND2-CE1 3.4Å; N404-C427 HydrophobicContact CB-CB 4.22Å; N404-C427 PolarHBondContact ND2-O 3.17Å; N404-C427 WeakPolarHBondContact O-CB 3.37Å; N404-R449 PolarHBondContact OD1-NH2 3.38Å
405	G	88.4	Confident	88.1	Confident	22 Å²	22	70.6 Å²	70.6	23%	0.227	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.9	146.8	-176.1	0	0	0	0	0	114.9	C401 D417	C401-G405 WeakPolarHBondContact CB-O 3.08Å; C401-G405 PolarHBondContact O-N 2.66Å; G405-D417 WeakPolarHBondContact CA-O 3.02Å
406	H	90.8	Very high	88.2	Confident	142 Å²	142	69.7 Å²	69.7	66%	0.657	39%	0.385	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.2	124.5	175.4	-171	-68	0	0	0	110.3	D417	H406-D417 PolarHBondContact N-O 2.84Å; H406-D417 PolarHBondContact O-N 2.89Å
407	C	92.9	Very high	88.4	Confident	25 Å²	25	68.7 Å²	68.7	17%	0.169	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	135.1	176.8	-164.2	0	0	0	0	111.5	C395 C401	C395-C407 WeakPolarHBondContact CA-SG 3.27Å; C395-C407 HydrophobicContact CB-CB 3.67Å; C395-C407 WeakPolarHBondContact CB-SG 3.4Å; C395-C407 WeakPolarHBondContact SG-CB 3.46Å; C395-C407 CovalentContact SG-SG 2.04Å; C395-C407 PolarHBondContact SG-SG 2.76Å; C401-C407 WeakPolarHBondContact SG-CA 3.05Å; C401-C407 VanDerWaalsContact SG-CB 3.5Å
408	R	92.2	Very high	88.7	Confident	120 Å²	120	67.2 Å²	67.2	45%	0.453	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	120.5	174.1	-168.7	-175.9	78.9	-149.7	11.5	110.2	C395 K415 D417	C395-R408 PolarHBondContact SG-N 3.45Å; R408-K415 PolarHBondContact N-O 3.24Å; R408-K415 PolarHBondContact O-N 2.83Å; R408-D417 IonicContact CZ-OD2 3.81Å; R408-D417 IonicContact NH1-OD1 3.79Å; R408-D417 PolarHBondContact NH1-OD1 3.11Å; R408-D417 IonicContact NH1-OD2 2.6Å; R408-D417 PolarHBondContact NH1-OD2 3.28Å
409	N	91	Very high	89.1	Confident	44 Å²	44	65.5 Å²	65.5	24%	0.235	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	144.7	176.8	-132.3	69.9	0	0	0	111.5	D391 I392 N393 E394 C395	D391-N409 PolarHBondContact OD2-ND2 3.26Å; I392-N409 PolarHBondContact O-ND2 2.03Å; I392-N409 PolarHBondContact O-OD1 3.37Å; N393-N409 WeakPolarHBondContact CA-OD1 3.11Å; N393-N409 PolarHBondContact OD1-OD1 2.95Å; E394-N409 PolarHBondContact N-OD1 3.03Å; C395-N409 PolarHBondContact SG-N 2.84Å; C395-N409 VanDerWaalsContact SG-N 3.44Å
410	V	90.4	Very high	89.3	Confident	70 Å²	70	65.7 Å²	65.7	42%	0.424	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	152	171.2	-160.2	0	0	0	0	106.6	G412 S413 K415	V410-G412 PolarHBondContact O-N 2.85Å; V410-S413 CarbonylContact C-O 3.49Å; V410-S413 VanDerWaalsContact CA-O 3.28Å; V410-S413 WeakPolarHBondContact CA-O 3.44Å; V410-S413 WeakPolarHBondContact CB-O 3.34Å; V410-S413 PolarHBondContact N-O 3.49Å; V410-S413 CarbonylContact O-C 3.55Å; V410-S413 PolarHBondContact O-N 3.03Å; V410-K415 HydrophobicContact CG2-CB 4.16Å
411	N	90.4	Very high	89.2	Confident	108 Å²	108	64.8 Å²	64.8	58%	0.578	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.7	108	-174.9	179.7	74	0	0	0	111.9	Y383 D391	Y383-N411 PolarHBondContact OH-ND2 2.98Å; Y383-N411 PolarHBondContact OH-O 2.95Å; D391-N411 WeakPolarHBondContact OD1-CA 3.49Å
412	G	85.8	Confident	89.3	Confident	21 Å²	21	65.9 Å²	65.9	22%	0.216	35%	0.348	C	S	.	.	T	Hydrogen-bonded Turn	trans	88.2	4.8	-176.8	0	0	0	0	0	116.4	Y383 D391 V410	Y383-G412 WeakPolarHBondContact OH-CA 3.28Å; Y383-G412 PolarHBondContact OH-N 2.88Å; D391-G412 PolarHBondContact OD1-N 3.26Å; V410-G412 PolarHBondContact O-N 2.85Å
413	S	90	Very high	89.5	Confident	62 Å²	62	68.8 Å²	68.8	43%	0.434	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-174.3	141	174.9	-176.5	0	0	0	0	112.5	E394 V410	E394-S413 VanDerWaalsContact OE2-C 3.3Å; E394-S413 WeakPolarHBondContact OE2-CA 3.49Å; V410-S413 CarbonylContact C-O 3.49Å; V410-S413 VanDerWaalsContact CA-O 3.28Å; V410-S413 WeakPolarHBondContact CA-O 3.44Å; V410-S413 WeakPolarHBondContact CB-O 3.34Å; V410-S413 PolarHBondContact N-O 3.49Å; V410-S413 CarbonylContact O-C 3.55Å; V410-S413 PolarHBondContact O-N 3.03Å
414	F	90.5	Very high	89.7	Confident	38 Å²	38	58.7 Å²	58.7	17%	0.167	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62	161.5	160.1	69	-80.8	0	0	0	112.9	E394 I400 R426	E394-F414 HydrophobicContact CB-CB 4.12Å; E394-F414 HydrophobicContact CB-CD1 3.85Å; E394-F414 HydrophobicContact CB-CG 4.34Å; E394-F414 HydrophobicContact CG-CD1 4.04Å; E394-F414 PolarHBondContact OE2-N 2.71Å; I400-F414 HydrophobicContact CG2-CD1 4.18Å; I400-F414 HydrophobicContact CG2-CD2 3.45Å; I400-F414 VanDerWaalsContact CG2-CD2 3.45Å; I400-F414 HydrophobicContact CG2-CE1 4.21Å; I400-F414 HydrophobicContact CG2-CE2 3.49Å; I400-F414 VanDerWaalsContact CG2-CE2 3.49Å; I400-F414 HydrophobicContact CG2-CG 3.84Å; I400-F414 HydrophobicContact CG2-CZ 3.9Å; F414-R426 HydrophobicContact CE2-CG 4.48Å
415	K	92	Very high	89.9	Confident	95 Å²	95	63.9 Å²	63.9	41%	0.413	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	139.1	158.4	177.8	-178	-175	-58.7	0	108.7	R408 V410 D417	R408-K415 PolarHBondContact N-O 3.24Å; R408-K415 PolarHBondContact O-N 2.83Å; V410-K415 HydrophobicContact CG2-CB 4.16Å; K415-D417 IonicContact NZ-OD1 2.86Å; K415-D417 PolarHBondContact NZ-OD1 3.28Å
416	C	93.7	Very high	89.9	Confident	8 Å²	8	67.6 Å²	67.6	5%	0.054	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	134.4	166.6	-59.4	0	0	0	0	111.2	C401 D425	C401-C416 WeakPolarHBondContact CA-SG 3.42Å; C401-C416 HydrophobicContact CB-CB 3.72Å; C401-C416 WeakPolarHBondContact CB-SG 3.06Å; C401-C416 VanDerWaalsContact SG-CA 3.51Å; C401-C416 WeakPolarHBondContact SG-CB 3.24Å; C401-C416 CovalentContact SG-SG 2.03Å; C401-C416 PolarHBondContact SG-SG 3.31Å; C416-D425 PolarHBondContact SG-O 3.34Å
417	D	92.3	Very high	89.9	Confident	61 Å²	61	60.9 Å²	60.9	33%	0.326	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	103.3	169	-69	-39.3	0	0	0	106.9	G405 H406 R408 K415	G405-D417 WeakPolarHBondContact CA-O 3.02Å; H406-D417 PolarHBondContact N-O 2.84Å; H406-D417 PolarHBondContact O-N 2.89Å; R408-D417 IonicContact CZ-OD2 3.81Å; R408-D417 IonicContact NH1-OD1 3.79Å; R408-D417 PolarHBondContact NH1-OD1 3.11Å; R408-D417 IonicContact NH1-OD2 2.6Å; R408-D417 PolarHBondContact NH1-OD2 3.28Å; K415-D417 IonicContact NZ-OD1 2.86Å; K415-D417 PolarHBondContact NZ-OD1 3.28Å
418	C	91.7	Very high	89.6	Confident	51 Å²	51	64.9 Å²	64.9	35%	0.345	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	156.4	-167.9	-54	0	0	0	0	114.5	N404 F422 C427	N404-C418 CarbonylContact O-C 3.57Å; N404-C418 WeakPolarHBondContact O-CA 3.34Å; C418-F422 HydrophobicContact CB-CB 4.36Å; C418-C427 WeakPolarHBondContact CA-SG 3.36Å; C418-C427 HydrophobicContact CB-CB 3.78Å; C418-C427 WeakPolarHBondContact CB-SG 3.41Å; C418-C427 VanDerWaalsContact SG-CA 3.56Å; C418-C427 WeakPolarHBondContact SG-CB 3.21Å; C418-C427 CovalentContact SG-SG 2.03Å; C418-C427 PolarHBondContact SG-SG 3.35Å
419	E	89.4	Confident	89.3	Confident	95 Å²	95	64.1 Å²	64.1	44%	0.444	34%	0.344	S	S	.	.	P	Polyproline II helix	trans	-66.9	158.4	162.3	-66	-166.3	161.7	0	0	111.1	N404 F422 R449	N404-E419 PolarHBondContact O-N 3.33Å; E419-F422 HydrophobicContact CB-CD2 4.47Å; E419-F422 PolarHBondContact O-N 3.29Å; E419-R449 IonicContact OE2-CZ 2.72Å; E419-R449 IonicContact OE2-NH1 2.75Å; E419-R449 PolarHBondContact OE2-NH1 2.89Å; E419-R449 IonicContact OE2-NH2 3.15Å; E419-R449 PolarHBondContact OE2-NH2 2.87Å
420	S	87.7	Confident	89.1	Confident	82 Å²	82	65.9 Å²	65.9	57%	0.573	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56	146.5	168.8	-47.3	0	0	0	0	111.1	F422 D450	S420-F422 VanDerWaalsContact C-N 3.33Å; S420-F422 WeakPolarHBondContact O-CD2 3.46Å; S420-D450 VanDerWaalsContact CB-CG 3.41Å; S420-D450 WeakPolarHBondContact CB-OD1 3.47Å; S420-D450 VanDerWaalsContact CB-OD2 3.24Å; S420-D450 WeakPolarHBondContact CB-OD2 3.04Å
421	G	84.3	Confident	88.9	Confident	2 Å²	2	65.9 Å²	65.9	2%	0.021	35%	0.348	C	S	.	.	T	Hydrogen-bonded Turn	trans	80.2	-1.5	-172.1	0	0	0	0	0	115.7	E430 I431 D450	G421-E430 WeakPolarHBondContact O-CA 3.39Å; G421-I431 PolarHBondContact O-N 3.14Å; G421-D450 PolarHBondContact N-OD1 3.47Å
422	F	89.9	Confident	88.8	Confident	26 Å²	26	64.7 Å²	64.7	11%	0.114	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	147	-177.5	-65.8	-85.3	0	0	0	115	N404 C418 E419 S420 C427 E429 E430 R449	N404-F422 HydrophobicContact CB-CB 4.05Å; N404-F422 HydrophobicContact CB-CD1 3.88Å; N404-F422 HydrophobicContact CB-CD2 3.62Å; N404-F422 HydrophobicContact CB-CE1 4.32Å; N404-F422 HydrophobicContact CB-CE2 4.09Å; N404-F422 HydrophobicContact CB-CG 3.52Å; N404-F422 HydrophobicContact CB-CZ 4.42Å; N404-F422 VanDerWaalsContact ND2-CD1 3.32Å; N404-F422 WeakPolarHBondContact ND2-CD1 3.45Å; N404-F422 WeakPolarHBondContact ND2-CE1 3.4Å; C418-F422 HydrophobicContact CB-CB 4.36Å; E419-F422 HydrophobicContact CB-CD2 4.47Å; E419-F422 PolarHBondContact O-N 3.29Å; S420-F422 VanDerWaalsContact C-N 3.33Å; S420-F422 WeakPolarHBondContact O-CD2 3.46Å; F422-C427 HydrophobicContact CB-CB 4.35Å; F422-E429 CarbonylContact C-O 3.34Å; F422-E429 WeakPolarHBondContact CA-O 3.21Å; F422-E429 WeakPolarHBondContact CD1-O 3.3Å; F422-E430 HydrophobicContact CD1-CB 4.29Å; F422-E430 HydrophobicContact CE1-CB 3.91Å; F422-E430 HydrophobicContact CE1-CG 4.3Å; F422-R449 HydrophobicContact CE2-CG 3.63Å; F422-R449 VanDerWaalsContact CE2-CZ 3.45Å; F422-R449 VanDerWaalsContact CE2-NE 3.26Å; F422-R449 HydrophobicContact CZ-CG 3.75Å
423	F	87.9	Confident	88.9	Confident	95 Å²	95	65.3 Å²	65.3	42%	0.417	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	-172.1	175.3	78.7	-74.6	0	0	0	111.8	C427 E428 E429 E430 I431	F423-C427 CarbonylContact O-C 3.51Å; F423-C427 VanDerWaalsContact O-CA 3.26Å; F423-C427 WeakPolarHBondContact O-CA 3.42Å; F423-E428 PolarHBondContact O-N 2.88Å; F423-E429 HydrophobicContact CD1-CB 3.88Å; F423-E429 HydrophobicContact CD2-CB 4.46Å; F423-E429 HydrophobicContact CE1-CB 3.58Å; F423-E429 HydrophobicContact CE2-CB 4.17Å; F423-E429 WeakPolarHBondContact CE2-OE2 3.19Å; F423-E429 HydrophobicContact CG-CB 4.33Å; F423-E429 HydrophobicContact CZ-CB 3.73Å; F423-E429 VanDerWaalsContact CZ-OE2 3.27Å; F423-E429 WeakPolarHBondContact CZ-OE2 3.49Å; F423-E429 PolarHBondContact N-O 3.41Å; F423-E429 PolarHBondContact O-N 2.86Å; F423-E429 VanDerWaalsContact O-N 3.11Å; F423-E430 WeakPolarHBondContact CE1-O 3.25Å; F423-I431 HydrophobicContact CB-CG1 4.44Å; F423-I431 HydrophobicContact CD1-CB 4.49Å; F423-I431 HydrophobicContact CD1-CG1 3.62Å; F423-I431 HydrophobicContact CE1-CG1 4.35Å; F423-I431 HydrophobicContact CG-CG1 4.4Å
424	G	87.7	Confident	88.9	Confident	32 Å²	32	63.3 Å²	63.3	33%	0.33	32%	0.324	S	S	.	.	S	Bend	trans	92.9	163.3	-168.2	0	0	0	0	0	112.3	R426 C427 E428	G424-R426 PolarHBondContact O-N 2.82Å; G424-R426 VanDerWaalsContact O-N 3.17Å; G424-C427 PolarHBondContact O-N 3.04Å; G424-E428 WeakPolarHBondContact CA-OE2 3.29Å
425	D	88.1	Confident	88.8	Confident	143 Å²	143	69.1 Å²	69.1	77%	0.765	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.4	-16.9	-177.7	-75.8	-32	0	0	0	112.9	C416 E428	C416-D425 PolarHBondContact SG-O 3.34Å; D425-E428 PolarHBondContact N-OE2 3.41Å
426	R	89.8	Confident	88.7	Confident	100 Å²	100	68.9 Å²	68.9	38%	0.377	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	-126.3	14.1	-179.5	-56.7	176.4	168.7	-82.5	-2.8	113.3	I400 C401 F414 G424 E428	I400-R426 WeakPolarHBondContact O-CB 3.16Å; I400-R426 WeakPolarHBondContact O-CG 3.08Å; I400-R426 PolarHBondContact O-NH1 3.4Å; C401-R426 CarbonylContact C-O 2.84Å; C401-R426 VanDerWaalsContact CA-O 3.31Å; C401-R426 WeakPolarHBondContact CA-O 3.47Å; C401-R426 VanDerWaalsContact O-O 3.12Å; F414-R426 HydrophobicContact CE2-CG 4.48Å; G424-R426 PolarHBondContact O-N 2.82Å; G424-R426 VanDerWaalsContact O-N 3.17Å; R426-E428 VanDerWaalsContact C-OE2 3.29Å; R426-E428 VanDerWaalsContact CA-OE2 3.29Å; R426-E428 WeakPolarHBondContact CA-OE2 2.99Å; R426-E428 WeakPolarHBondContact CB-OE1 3.1Å; R426-E428 WeakPolarHBondContact CB-OE2 3.46Å; R426-E428 PolarHBondContact N-OE2 2.8Å; R426-E428 PolarHBondContact O-N 2.03Å
427	C	90.3	Very high	88.5	Confident	0 Å²	0	74.8 Å²	74.8	0%	0	39%	0.394	C	S	.	.	S	Bend	trans	57.1	34.8	-176	-43.4	0	0	0	0	112.5	N404 C418 F422 F423 G424	N404-C427 HydrophobicContact CB-CB 4.22Å; N404-C427 PolarHBondContact ND2-O 3.17Å; N404-C427 WeakPolarHBondContact O-CB 3.37Å; C418-C427 WeakPolarHBondContact CA-SG 3.36Å; C418-C427 HydrophobicContact CB-CB 3.78Å; C418-C427 WeakPolarHBondContact CB-SG 3.41Å; C418-C427 VanDerWaalsContact SG-CA 3.56Å; C418-C427 WeakPolarHBondContact SG-CB 3.21Å; C418-C427 CovalentContact SG-SG 2.03Å; C418-C427 PolarHBondContact SG-SG 3.35Å; F422-C427 HydrophobicContact CB-CB 4.35Å; F423-C427 CarbonylContact O-C 3.51Å; F423-C427 VanDerWaalsContact O-CA 3.26Å; F423-C427 WeakPolarHBondContact O-CA 3.42Å; G424-C427 PolarHBondContact O-N 3.04Å
428	E	87.1	Confident	88.5	Confident	110 Å²	110	72.8 Å²	72.8	51%	0.514	38%	0.384	S	S	.	.			trans	-90.8	-17.7	-176.1	68.7	-90.1	-109.7	0	0	114.1	F423 G424 D425 R426	F423-E428 PolarHBondContact O-N 2.88Å; G424-E428 WeakPolarHBondContact CA-OE2 3.29Å; D425-E428 PolarHBondContact N-OE2 3.41Å; R426-E428 VanDerWaalsContact C-OE2 3.29Å; R426-E428 VanDerWaalsContact CA-OE2 3.29Å; R426-E428 WeakPolarHBondContact CA-OE2 2.99Å; R426-E428 WeakPolarHBondContact CB-OE1 3.1Å; R426-E428 WeakPolarHBondContact CB-OE2 3.46Å; R426-E428 PolarHBondContact N-OE2 2.8Å; R426-E428 PolarHBondContact O-N 2.03Å
429	E	85.9	Confident	88.4	Confident	104 Å²	104	71.2 Å²	71.2	49%	0.486	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	135.3	178.3	-51.5	-161.6	144	0	0	110	F422 F423	F422-E429 CarbonylContact C-O 3.34Å; F422-E429 WeakPolarHBondContact CA-O 3.21Å; F422-E429 WeakPolarHBondContact CD1-O 3.3Å; F423-E429 HydrophobicContact CD1-CB 3.88Å; F423-E429 HydrophobicContact CD2-CB 4.46Å; F423-E429 HydrophobicContact CE1-CB 3.58Å; F423-E429 HydrophobicContact CE2-CB 4.17Å; F423-E429 WeakPolarHBondContact CE2-OE2 3.19Å; F423-E429 HydrophobicContact CG-CB 4.33Å; F423-E429 HydrophobicContact CZ-CB 3.73Å; F423-E429 VanDerWaalsContact CZ-OE2 3.27Å; F423-E429 WeakPolarHBondContact CZ-OE2 3.49Å; F423-E429 PolarHBondContact N-O 3.41Å; F423-E429 PolarHBondContact O-N 2.86Å; F423-E429 VanDerWaalsContact O-N 3.11Å
430	E	86.3	Confident	88.5	Confident	81 Å²	81	69.5 Å²	69.5	38%	0.379	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	141.5	172.7	-179.6	178.8	-134.4	0	0	108.8	G421 F422 F423 D432 R449	G421-E430 WeakPolarHBondContact O-CA 3.39Å; F422-E430 HydrophobicContact CD1-CB 4.29Å; F422-E430 HydrophobicContact CE1-CB 3.91Å; F422-E430 HydrophobicContact CE1-CG 4.3Å; F423-E430 WeakPolarHBondContact CE1-O 3.25Å; E430-D432 PolarHBondContact O-N 3.45Å; E430-R449 WeakPolarHBondContact OE1-CA 3.36Å; E430-R449 WeakPolarHBondContact OE1-CB 3.02Å; E430-R449 PolarHBondContact OE1-N 2.62Å
431	I	86.3	Confident	88.4	Confident	70 Å²	70	69.3 Å²	69.3	36%	0.359	36%	0.362	S	S	.	.			trans	-76	111.5	-180	-59	171.3	0	0	0	108.9	G421 F423 E433	G421-I431 PolarHBondContact O-N 3.14Å; F423-I431 HydrophobicContact CB-CG1 4.44Å; F423-I431 HydrophobicContact CD1-CB 4.49Å; F423-I431 HydrophobicContact CD1-CG1 3.62Å; F423-I431 HydrophobicContact CE1-CG1 4.35Å; F423-I431 HydrophobicContact CG-CG1 4.4Å; I431-E433 HydrophobicContact CG2-CG 4.2Å; I431-E433 PolarHBondContact O-N 3.28Å
432	D	87.2	Confident	88.2	Confident	83 Å²	83	71.8 Å²	71.8	44%	0.444	39%	0.387	S	S	.	.			trans	-67.9	94.3	169.9	-176.6	-26.8	0	0	0	109.2	E430 C434 E435	E430-D432 PolarHBondContact O-N 3.45Å; D432-C434 PolarHBondContact O-N 2.84Å; D432-C434 VanDerWaalsContact OD1-CA 3.27Å; D432-C434 WeakPolarHBondContact OD1-CA 3.42Å; D432-C434 WeakPolarHBondContact OD1-CB 3.46Å; D432-C434 PolarHBondContact OD1-N 2.87Å; D432-E435 WeakPolarHBondContact O-CB 3.31Å; D432-E435 PolarHBondContact O-N 2.04Å; D432-E435 PolarHBondContact OD1-N 3.2Å
433	E	88.3	Confident	88	Confident	34 Å²	34	71 Å²	71	16%	0.159	39%	0.387	C	S	.	.	G	3₁₀ helix	trans	-72.3	-18.2	-178.5	-71.1	149.7	-159.1	0	0	111.6	I431 E435 S436 D447 D450 A451 Y452	I431-E433 HydrophobicContact CG2-CG 4.2Å; I431-E433 PolarHBondContact O-N 3.28Å; E433-E435 VanDerWaalsContact C-N 3.32Å; E433-S436 WeakPolarHBondContact O-CB 3.05Å; E433-S436 PolarHBondContact O-N 3.3Å; E433-S436 PolarHBondContact O-OG 2.03Å; E433-D447 PolarHBondContact N-OD1 3.24Å; E433-D450 WeakPolarHBondContact OE1-CA 3.4Å; E433-D450 PolarHBondContact OE1-N 3.08Å; E433-A451 VanDerWaalsContact OE2-C 3.3Å; E433-A451 WeakPolarHBondContact OE2-CA 3.39Å; E433-A451 PolarHBondContact OE2-N 2.9Å; E433-Y452 HydrophobicContact CB-CD1 3.86Å; E433-Y452 HydrophobicContact CB-CG 4.42Å; E433-Y452 PolarHBondContact OE2-N 3.47Å
434	C	90.5	Very high	87.9	Confident	19 Å²	19	71.7 Å²	71.7	13%	0.128	39%	0.387	C	S	.	.	G	3₁₀ helix	trans	-72.7	-19.1	172.4	-68.6	0	0	0	0	113.3	D432 S436 N437 C445 D447	D432-C434 PolarHBondContact O-N 2.84Å; D432-C434 VanDerWaalsContact OD1-CA 3.27Å; D432-C434 WeakPolarHBondContact OD1-CA 3.42Å; D432-C434 WeakPolarHBondContact OD1-CB 3.46Å; D432-C434 PolarHBondContact OD1-N 2.87Å; C434-S436 PolarHBondContact O-N 2.68Å; C434-N437 WeakPolarHBondContact O-CA 3.25Å; C434-N437 PolarHBondContact O-N 3.44Å; C434-C445 WeakPolarHBondContact CA-SG 3.17Å; C434-C445 HydrophobicContact CB-CB 3.64Å; C434-C445 WeakPolarHBondContact CB-SG 3.47Å; C434-C445 WeakPolarHBondContact SG-CB 3.33Å; C434-C445 CovalentContact SG-SG 2.03Å; C434-C445 PolarHBondContact SG-SG 3.04Å; C434-D447 HydrophobicContact CB-CB 4.49Å; C434-D447 PolarHBondContact SG-N 3.46Å
435	E	89.4	Confident	87.9	Confident	161 Å²	161	71.3 Å²	71.3	75%	0.752	38%	0.379	S	S	*	.	G	3₁₀ helix	trans	-57.4	-33	170.3	-168.9	-178.1	-152.5	0	0	111	D432 E433 N437	D432-E435 WeakPolarHBondContact O-CB 3.31Å; D432-E435 PolarHBondContact O-N 2.04Å; D432-E435 PolarHBondContact OD1-N 3.2Å; E433-E435 VanDerWaalsContact C-N 3.32Å; E435-N437 PolarHBondContact O-N 3.29Å; E435-N437 VanDerWaalsContact O-N 3.1Å; E435-N437 PolarHBondContact O-ND2 2.91Å
436	S	89.3	Confident	87.8	Confident	89 Å²	89	66.9 Å²	66.9	62%	0.622	36%	0.356	S	S	*	.	G	3₁₀ helix	trans	-66.6	-9	174.8	77.4	0	0	0	0	114.4	E433 C434 P438	E433-S436 WeakPolarHBondContact O-CB 3.05Å; E433-S436 PolarHBondContact O-N 3.3Å; E433-S436 PolarHBondContact O-OG 2.03Å; C434-S436 PolarHBondContact O-N 2.68Å; S436-P438 WeakPolarHBondContact OG-CD 3.24Å
437	N	88.7	Confident	87.5	Confident	133 Å²	133	65.4 Å²	65.4	71%	0.711	36%	0.355	S	S	*	.			trans	51.8	56.1	-175	-72.9	-105.9	0	0	0	113	C434 E435 C439	C434-N437 WeakPolarHBondContact O-CA 3.25Å; C434-N437 PolarHBondContact O-N 3.44Å; E435-N437 PolarHBondContact O-N 3.29Å; E435-N437 VanDerWaalsContact O-N 3.1Å; E435-N437 PolarHBondContact O-ND2 2.91Å; N437-C439 VanDerWaalsContact C-N 3.26Å; N437-C439 PolarHBondContact O-N 2.91Å
438	P	92	Very high	86.9	Confident	18 Å²	18	66.4 Å²	66.4	12%	0.117	37%	0.365	C	S	.	.			trans	-71.9	-19.4	-172.9	30.7	-34.9	0	0	0	113.3	S436 T440 Y452 H464	S436-P438 WeakPolarHBondContact OG-CD 3.24Å; P438-T440 PolarHBondContact O-N 3.09Å; P438-Y452 HydrophobicContact CB-CD2 4.1Å; P438-Y452 HydrophobicContact CB-CE1 4.16Å; P438-Y452 HydrophobicContact CB-CE2 3.55Å; P438-Y452 HydrophobicContact CG-CD1 4.2Å; P438-Y452 HydrophobicContact CG-CD2 3.51Å; P438-Y452 HydrophobicContact CG-CE1 4.19Å; P438-Y452 HydrophobicContact CG-CE2 3.51Å; P438-Y452 HydrophobicContact CG-CG 3.87Å; P438-H464 WeakPolarHBondContact O-CB 3.22Å
439	C	91.1	Very high	86.7	Confident	18 Å²	18	67.2 Å²	67.2	12%	0.122	36%	0.364	C	S	.	.			trans	-85.3	109.6	-176.3	-52.1	0	0	0	0	112	N437 G443 C445 C454	N437-C439 VanDerWaalsContact C-N 3.26Å; N437-C439 PolarHBondContact O-N 2.91Å; C439-G443 WeakPolarHBondContact CB-O 3.31Å; C439-C445 HydrophobicContact CB-CB 4.45Å; C439-C445 VanDerWaalsContact SG-CA 3.55Å; C439-C445 WeakPolarHBondContact SG-CB 3.47Å; C439-C445 VanDerWaalsContact SG-SG 3.62Å; C439-C454 WeakPolarHBondContact CA-SG 3.03Å; C439-C454 HydrophobicContact CB-CB 3.8Å; C439-C454 WeakPolarHBondContact CB-SG 3.34Å; C439-C454 WeakPolarHBondContact SG-CA 3.42Å; C439-C454 WeakPolarHBondContact SG-CB 3.32Å; C439-C454 CovalentContact SG-SG 2.03Å; C439-C454 PolarHBondContact SG-SG 2.04Å
440	T	91	Very high	86.5	Confident	59 Å²	59	66.6 Å²	66.6	36%	0.362	36%	0.363	S	S	.	.			trans	-80.6	174.8	178.3	75	0	0	0	0	112.3	P438 G442 G443 H464 C465 E466	P438-T440 PolarHBondContact O-N 3.09Å; T440-G442 PolarHBondContact O-N 2.76Å; T440-G443 PolarHBondContact O-N 2.99Å; T440-H464 WeakPolarHBondContact CA-O 3.44Å; T440-H464 WeakPolarHBondContact CB-O 3.27Å; T440-H464 HydrophobicContact CG2-CB 4.38Å; T440-H464 PolarHBondContact N-O 3.4Å; T440-H464 PolarHBondContact OG1-O 3.28Å; T440-C465 PolarHBondContact OG1-O 3.37Å; T440-E466 WeakPolarHBondContact OG1-CA 3.45Å; T440-E466 PolarHBondContact OG1-N 2.83Å
441	N	85	Confident	86.4	Confident	78 Å²	78	65.8 Å²	65.8	42%	0.417	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.4	23.9	177.1	-64.2	-59.2	0	0	0	115.2	Y460 C465	N441-Y460 HydrophobicContact CB-CD1 3.57Å; N441-Y460 HydrophobicContact CB-CD2 4.28Å; N441-Y460 HydrophobicContact CB-CE1 3.46Å; N441-Y460 VanDerWaalsContact CB-CE1 3.46Å; N441-Y460 HydrophobicContact CB-CE2 4.19Å; N441-Y460 HydrophobicContact CB-CG 3.98Å; N441-Y460 WeakPolarHBondContact ND2-CE1 3.36Å; N441-Y460 WeakPolarHBondContact OD1-CE1 3.02Å; N441-C465 PolarHBondContact ND2-O 2.97Å
442	G	81.2	Confident	86.4	Confident	54 Å²	54	65.8 Å²	65.8	56%	0.557	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.7	7.6	-179.2	0	0	0	0	0	115	T440 F457	T440-G442 PolarHBondContact O-N 2.76Å; G442-F457 WeakPolarHBondContact O-CD2 3Å; G442-F457 WeakPolarHBondContact O-CE2 3.39Å
443	G	84.9	Confident	86.4	Confident	10 Å²	10	67 Å²	67	10%	0.103	37%	0.373	C	S	.	.	P	Polyproline II helix	trans	-53.3	138.1	176.7	0	0	0	0	0	112.5	C439 T440 I455	C439-G443 WeakPolarHBondContact CB-O 3.31Å; T440-G443 PolarHBondContact O-N 2.99Å; G443-I455 CarbonylContact C-O 3.55Å; G443-I455 WeakPolarHBondContact CA-O 3.34Å
444	Y	85.1	Confident	86.4	Confident	109 Å²	109	66 Å²	66	43%	0.427	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	120.1	179.8	-173.2	-105.1	0	0	0	110.1	N67 L446 I455	N67-Y444 PolarHBondContact ND2-OH 2.98Å; Y444-L446 HydrophobicContact CD1-CD2 4.2Å; Y444-L446 HydrophobicContact CD1-CG 4.47Å; Y444-L446 HydrophobicContact CE1-CD2 3.73Å; Y444-L446 HydrophobicContact CE1-CG 4.47Å; Y444-I455 PolarHBondContact N-O 2.82Å; Y444-I455 PolarHBondContact O-N 2.93Å
445	C	89.3	Confident	86.1	Confident	24 Å²	24	69.1 Å²	69.1	16%	0.162	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	132.4	179.1	-161	0	0	0	0	110.8	C434 C439	C434-C445 WeakPolarHBondContact CA-SG 3.17Å; C434-C445 HydrophobicContact CB-CB 3.64Å; C434-C445 WeakPolarHBondContact CB-SG 3.47Å; C434-C445 WeakPolarHBondContact SG-CB 3.33Å; C434-C445 CovalentContact SG-SG 2.03Å; C434-C445 PolarHBondContact SG-SG 3.04Å; C439-C445 HydrophobicContact CB-CB 4.45Å; C439-C445 VanDerWaalsContact SG-CA 3.55Å; C439-C445 WeakPolarHBondContact SG-CB 3.47Å; C439-C445 VanDerWaalsContact SG-SG 3.62Å
446	L	85.6	Confident	85.7	Confident	51 Å²	51	63.2 Å²	63.2	27%	0.267	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	126.1	163.9	-71.6	-178.7	0	0	0	108.8	Y444 Y452 L453 I455	Y444-L446 HydrophobicContact CD1-CD2 4.2Å; Y444-L446 HydrophobicContact CD1-CG 4.47Å; Y444-L446 HydrophobicContact CE1-CD2 3.73Å; Y444-L446 HydrophobicContact CE1-CG 4.47Å; L446-Y452 CarbonylContact O-C 3.4Å; L446-Y452 WeakPolarHBondContact O-CA 3.3Å; L446-L453 HydrophobicContact CB-CB 4.44Å; L446-L453 PolarHBondContact N-O 3.44Å; L446-L453 PolarHBondContact O-N 2.89Å; L446-I455 HydrophobicContact CD1-CD1 3.54Å; L446-I455 HydrophobicContact CD1-CG1 4.26Å; L446-I455 HydrophobicContact CG-CD1 4.06Å
447	D	83.6	Confident	85.2	Confident	68 Å²	68	64.5 Å²	64.5	36%	0.364	35%	0.354	S	S	.	.			trans	-81	160.8	178.9	-179.5	50	0	0	0	112.3	E433 C434	E433-D447 PolarHBondContact N-OD1 3.24Å; C434-D447 HydrophobicContact CB-CB 4.49Å; C434-D447 PolarHBondContact SG-N 3.46Å
448	G	78.3	Confident	84.3	Confident	21 Å²	21	64.3 Å²	64.3	22%	0.216	35%	0.353	C	S	.	.			trans	169.6	156.3	175.3	0	0	0	0	0	115	D450 A451	G448-D450 PolarHBondContact O-N 2.95Å; G448-A451 CarbonylContact O-C 3.45Å; G448-A451 PolarHBondContact O-N 2.77Å
449	R	80.9	Confident	83.3	Confident	128 Å²	128	63.9 Å²	63.9	48%	0.483	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-39	100.2	-172.6	-165	-176.9	-156.5	-91.2	2.5	116.1	N404 E419 F422 E430 A451	N404-R449 PolarHBondContact OD1-NH2 3.38Å; E419-R449 IonicContact OE2-CZ 2.72Å; E419-R449 IonicContact OE2-NH1 2.75Å; E419-R449 PolarHBondContact OE2-NH1 2.89Å; E419-R449 IonicContact OE2-NH2 3.15Å; E419-R449 PolarHBondContact OE2-NH2 2.87Å; F422-R449 HydrophobicContact CE2-CG 3.63Å; F422-R449 VanDerWaalsContact CE2-CZ 3.45Å; F422-R449 VanDerWaalsContact CE2-NE 3.26Å; F422-R449 HydrophobicContact CZ-CG 3.75Å; E430-R449 WeakPolarHBondContact OE1-CA 3.36Å; E430-R449 WeakPolarHBondContact OE1-CB 3.02Å; E430-R449 PolarHBondContact OE1-N 2.62Å; R449-A451 PolarHBondContact O-N 2.97Å
450	D	82.4	Confident	82.9	Confident	90 Å²	90	66.8 Å²	66.8	48%	0.481	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	60.7	19.1	178.2	-155.3	47.4	0	0	0	113.1	S420 G421 E433 G448	S420-D450 VanDerWaalsContact CB-CG 3.41Å; S420-D450 WeakPolarHBondContact CB-OD1 3.47Å; S420-D450 VanDerWaalsContact CB-OD2 3.24Å; S420-D450 WeakPolarHBondContact CB-OD2 3.04Å; G421-D450 PolarHBondContact N-OD1 3.47Å; E433-D450 WeakPolarHBondContact OE1-CA 3.4Å; E433-D450 PolarHBondContact OE1-N 3.08Å; G448-D450 PolarHBondContact O-N 2.95Å
451	A	84.1	Confident	82.4	Confident	65 Å²	65	68.2 Å²	68.2	54%	0.537	36%	0.363	S	S	.	.			trans	-167.3	106.2	179.5	0	0	0	0	0	115.2	E433 G448 R449	E433-A451 VanDerWaalsContact OE2-C 3.3Å; E433-A451 WeakPolarHBondContact OE2-CA 3.39Å; E433-A451 PolarHBondContact OE2-N 2.9Å; G448-A451 CarbonylContact O-C 3.45Å; G448-A451 PolarHBondContact O-N 2.77Å; R449-A451 PolarHBondContact O-N 2.97Å
452	Y	87	Confident	82.4	Confident	69 Å²	69	66.4 Å²	66.4	27%	0.271	36%	0.363	S	S	.	.			trans	-70.1	162.5	162.4	70.1	-86.5	0	0	0	114.9	E433 P438 L446 H464	E433-Y452 HydrophobicContact CB-CD1 3.86Å; E433-Y452 HydrophobicContact CB-CG 4.42Å; E433-Y452 PolarHBondContact OE2-N 3.47Å; P438-Y452 HydrophobicContact CB-CD2 4.1Å; P438-Y452 HydrophobicContact CB-CE1 4.16Å; P438-Y452 HydrophobicContact CB-CE2 3.55Å; P438-Y452 HydrophobicContact CG-CD1 4.2Å; P438-Y452 HydrophobicContact CG-CD2 3.51Å; P438-Y452 HydrophobicContact CG-CE1 4.19Å; P438-Y452 HydrophobicContact CG-CE2 3.51Å; P438-Y452 HydrophobicContact CG-CG 3.87Å; L446-Y452 CarbonylContact O-C 3.4Å; L446-Y452 WeakPolarHBondContact O-CA 3.3Å; Y452-H464 PolarHBondContact OH-CD2 3Å; Y452-H464 VanDerWaalsContact OH-CD2 3.28Å; Y452-H464 PolarHBondContact OH-NE2 2.78Å
453	L	86.1	Confident	82.7	Confident	108 Å²	108	69.8 Å²	69.8	57%	0.565	37%	0.367	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-136	121.5	175.3	172.5	63.4	0	0	0	111.7	L446	L446-L453 HydrophobicContact CB-CB 4.44Å; L446-L453 PolarHBondContact N-O 3.44Å; L446-L453 PolarHBondContact O-N 2.89Å
454	C	88.8	Confident	83	Confident	13 Å²	13	72.3 Å²	72.3	9%	0.088	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	121.1	173.7	-62.2	0	0	0	0	112.9	C439 I463	C439-C454 WeakPolarHBondContact CA-SG 3.03Å; C439-C454 HydrophobicContact CB-CB 3.8Å; C439-C454 WeakPolarHBondContact CB-SG 3.34Å; C439-C454 WeakPolarHBondContact SG-CA 3.42Å; C439-C454 WeakPolarHBondContact SG-CB 3.32Å; C439-C454 CovalentContact SG-SG 2.03Å; C439-C454 PolarHBondContact SG-SG 2.04Å; C454-I463 WeakPolarHBondContact CB-O 3.38Å; C454-I463 PolarHBondContact SG-O 2.84Å; C454-I463 VanDerWaalsContact SG-O 3.37Å
455	I	84.2	Confident	83.2	Confident	86 Å²	86	67.1 Å²	67.1	44%	0.441	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	105	166.9	-62.4	179.7	0	0	0	108.6	G443 Y444 L446	G443-I455 CarbonylContact C-O 3.55Å; G443-I455 WeakPolarHBondContact CA-O 3.34Å; Y444-I455 PolarHBondContact N-O 2.82Å; Y444-I455 PolarHBondContact O-N 2.93Å; L446-I455 HydrophobicContact CD1-CD1 3.54Å; L446-I455 HydrophobicContact CD1-CG1 4.26Å; L446-I455 HydrophobicContact CG-CD1 4.06Å
456	C	81.4	Confident	83.2	Confident	36 Å²	36	69.3 Å²	69.3	24%	0.243	36%	0.363	C	S	.	.	P	Polyproline II helix	trans	-72	144.4	-175.3	-53.7	0	0	0	0	113.6	Y460 C465	C456-Y460 WeakPolarHBondContact CB-O 3.26Å; C456-C465 WeakPolarHBondContact CA-SG 3.21Å; C456-C465 HydrophobicContact CB-CB 3.72Å; C456-C465 WeakPolarHBondContact CB-SG 3.5Å; C456-C465 WeakPolarHBondContact SG-CA 3.22Å; C456-C465 WeakPolarHBondContact SG-CB 3.41Å; C456-C465 CovalentContact SG-SG 2.04Å; C456-C465 PolarHBondContact SG-SG 3.32Å
457	F	77.7	Confident	83.1	Confident	116 Å²	116	72 Å²	72	51%	0.509	37%	0.374	S	S	.	.	P	Polyproline II helix	trans	-65.5	151.4	167.9	-96.6	-108	0	0	0	110.8	G442 G459 Y460	G442-F457 WeakPolarHBondContact O-CD2 3Å; G442-F457 WeakPolarHBondContact O-CE2 3.39Å; F457-G459 PolarHBondContact O-N 2.61Å; F457-Y460 PolarHBondContact O-N 3.35Å
458	L	69.8	Low	83	Confident	130 Å²	130	74.6 Å²	74.6	68%	0.681	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	121.3	-176.4	-65	168.9	0	0	0	111.1
459	G	71.6	Confident	83	Confident	9 Å²	9	75.6 Å²	75.6	9%	0.093	38%	0.382	C	S	.	.	T	Hydrogen-bonded Turn	trans	104.5	0.5	-173.8	0	0	0	0	0	115.1	F457 I469	F457-G459 PolarHBondContact O-N 2.61Å; G459-I469 PolarHBondContact O-N 2.9Å
460	Y	83.1	Confident	82.9	Confident	78 Å²	78	72.3 Å²	72.3	31%	0.306	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	149.1	177.8	-66.1	-90.9	0	0	0	113.3	N441 C456 F457 H467 K468	N441-Y460 HydrophobicContact CB-CD1 3.57Å; N441-Y460 HydrophobicContact CB-CD2 4.28Å; N441-Y460 HydrophobicContact CB-CE1 3.46Å; N441-Y460 VanDerWaalsContact CB-CE1 3.46Å; N441-Y460 HydrophobicContact CB-CE2 4.19Å; N441-Y460 HydrophobicContact CB-CG 3.98Å; N441-Y460 WeakPolarHBondContact ND2-CE1 3.36Å; N441-Y460 WeakPolarHBondContact OD1-CE1 3.02Å; C456-Y460 WeakPolarHBondContact CB-O 3.26Å; F457-Y460 PolarHBondContact O-N 3.35Å; Y460-H467 CarbonylContact C-O 2.99Å; Y460-H467 VanDerWaalsContact CA-O 3.27Å; Y460-H467 WeakPolarHBondContact CA-O 3.02Å; Y460-K468 HydrophobicContact CD1-CB 4.4Å; Y460-K468 HydrophobicContact CE1-CB 4.27Å
461	E	79.6	Confident	82.7	Confident	90 Å²	90	70.3 Å²	70.3	42%	0.421	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	175.9	178.9	69.3	-174	166.8	0	0	110.9	C465 E466 H467 I469	E461-C465 CarbonylContact O-C 3.39Å; E461-C465 VanDerWaalsContact O-C 3.3Å; E461-C465 WeakPolarHBondContact O-CA 3.5Å; E461-E466 PolarHBondContact O-N 2.83Å; E461-H467 HydrophobicContact CG-CB 3.75Å; E461-H467 PolarHBondContact N-O 3.05Å; E461-H467 WeakPolarHBondContact O-CB 3.24Å; E461-H467 PolarHBondContact O-N 3.28Å; E461-I469 HydrophobicContact CB-CD1 4.39Å; E461-I469 HydrophobicContact CB-CG1 3.83Å; E461-I469 HydrophobicContact CG-CG1 3.92Å
462	G	85	Confident	82.8	Confident	39 Å²	39	68.5 Å²	68.5	40%	0.402	35%	0.345	S	S	.	.	S	Bend	trans	102.2	172.3	-174.7	0	0	0	0	0	113	H464 E466	G462-H464 VanDerWaalsContact C-N 3.35Å; G462-E466 VanDerWaalsContact CA-OE2 3.23Å; G462-E466 WeakPolarHBondContact CA-OE2 3.33Å
463	I	88.3	Confident	82.6	Confident	125 Å²	125	73.1 Å²	73.1	64%	0.641	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72	-34.6	-176.1	-62.9	173.9	0	0	0	110.7	C454 E466	C454-I463 WeakPolarHBondContact CB-O 3.38Å; C454-I463 PolarHBondContact SG-O 2.84Å; C454-I463 VanDerWaalsContact SG-O 3.37Å; I463-E466 PolarHBondContact N-OE2 2.94Å
464	H	91.2	Very high	82.2	Confident	63 Å²	63	72.4 Å²	72.4	29%	0.292	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.2	14.8	180	-44.9	93	0	0	0	111.1	P438 T440 Y452 G462 E466	P438-H464 WeakPolarHBondContact O-CB 3.22Å; T440-H464 WeakPolarHBondContact CA-O 3.44Å; T440-H464 WeakPolarHBondContact CB-O 3.27Å; T440-H464 HydrophobicContact CG2-CB 4.38Å; T440-H464 PolarHBondContact N-O 3.4Å; T440-H464 PolarHBondContact OG1-O 3.28Å; Y452-H464 PolarHBondContact OH-CD2 3Å; Y452-H464 VanDerWaalsContact OH-CD2 3.28Å; Y452-H464 PolarHBondContact OH-NE2 2.78Å; G462-H464 VanDerWaalsContact C-N 3.35Å; H464-E466 WeakPolarHBondContact CA-OE2 3.45Å; H464-E466 HydrophobicContact CB-CB 4.41Å; H464-E466 IonicContact CE1-OE1 2.7Å; H464-E466 IonicContact CG-OE1 3.06Å; H464-E466 PolarHBondContact N-OE2 2.85Å; H464-E466 IonicContact ND1-OE1 3.38Å; H464-E466 PolarHBondContact ND1-OE1 3.29Å; H464-E466 IonicContact ND1-OE2 2.64Å; H464-E466 PolarHBondContact O-N 3.15Å
465	C	88.2	Confident	81.8	Confident	0 Å²	0	75.6 Å²	75.6	0%	0	38%	0.384	C	S	.	.	S	Bend	trans	55.5	27.8	-170.4	-51.4	0	0	0	0	113.9	T440 N441 C456 E461 H467	T440-C465 PolarHBondContact OG1-O 3.37Å; N441-C465 PolarHBondContact ND2-O 2.97Å; C456-C465 WeakPolarHBondContact CA-SG 3.21Å; C456-C465 HydrophobicContact CB-CB 3.72Å; C456-C465 WeakPolarHBondContact CB-SG 3.5Å; C456-C465 WeakPolarHBondContact SG-CA 3.22Å; C456-C465 WeakPolarHBondContact SG-CB 3.41Å; C456-C465 CovalentContact SG-SG 2.04Å; C456-C465 PolarHBondContact SG-SG 3.32Å; E461-C465 CarbonylContact O-C 3.39Å; E461-C465 VanDerWaalsContact O-C 3.3Å; E461-C465 WeakPolarHBondContact O-CA 3.5Å; C465-H467 VanDerWaalsContact C-N 3.33Å; C465-H467 PolarHBondContact O-N 3.45Å
466	E	90.5	Very high	82	Confident	70 Å²	70	77.9 Å²	77.9	33%	0.327	39%	0.393	S	S	.	.			trans	-76.7	-16.8	-171.6	65.5	-89.4	-117.1	0	0	113.7	T440 E461 G462 I463 H464	T440-E466 WeakPolarHBondContact OG1-CA 3.45Å; T440-E466 PolarHBondContact OG1-N 2.83Å; E461-E466 PolarHBondContact O-N 2.83Å; G462-E466 VanDerWaalsContact CA-OE2 3.23Å; G462-E466 WeakPolarHBondContact CA-OE2 3.33Å; I463-E466 PolarHBondContact N-OE2 2.94Å; H464-E466 WeakPolarHBondContact CA-OE2 3.45Å; H464-E466 HydrophobicContact CB-CB 4.41Å; H464-E466 IonicContact CE1-OE1 2.7Å; H464-E466 IonicContact CG-OE1 3.06Å; H464-E466 PolarHBondContact N-OE2 2.85Å; H464-E466 IonicContact ND1-OE1 3.38Å; H464-E466 PolarHBondContact ND1-OE1 3.29Å; H464-E466 IonicContact ND1-OE2 2.64Å; H464-E466 PolarHBondContact O-N 3.15Å
467	H	84.2	Confident	82.3	Confident	108 Å²	108	76.9 Å²	76.9	50%	0.5	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	135.4	-178.8	-59.5	-32.4	0	0	0	110.6	Y460 E461 C465	Y460-H467 CarbonylContact C-O 2.99Å; Y460-H467 VanDerWaalsContact CA-O 3.27Å; Y460-H467 WeakPolarHBondContact CA-O 3.02Å; E461-H467 HydrophobicContact CG-CB 3.75Å; E461-H467 PolarHBondContact N-O 3.05Å; E461-H467 WeakPolarHBondContact O-CB 3.24Å; E461-H467 PolarHBondContact O-N 3.28Å; C465-H467 VanDerWaalsContact C-N 3.33Å; C465-H467 PolarHBondContact O-N 3.45Å
468	K	81.4	Confident	82.8	Confident	122 Å²	122	77.1 Å²	77.1	53%	0.53	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	128.3	168	-175.8	-176.9	174.1	-174.7	0	108.6	Y460 D470	Y460-K468 HydrophobicContact CD1-CB 4.4Å; Y460-K468 HydrophobicContact CE1-CB 4.27Å; K468-D470 PolarHBondContact O-N 2.94Å
469	I	77.1	Confident	83.6	Confident	42 Å²	42	73 Å²	73	22%	0.215	37%	0.368	C	S	.	.	P	Polyproline II helix	trans	-60.3	134	177.8	-60.5	171.2	0	0	0	109.2	G459 E461 N485	G459-I469 PolarHBondContact O-N 2.9Å; E461-I469 HydrophobicContact CB-CD1 4.39Å; E461-I469 HydrophobicContact CB-CG1 3.83Å; E461-I469 HydrophobicContact CG-CG1 3.92Å; I469-N485 PolarHBondContact O-ND2 2.92Å; I469-N485 PolarHBondContact O-OD1 3.41Å
470	D	80.2	Confident	84.3	Confident	60 Å²	60	79.3 Å²	79.3	32%	0.321	40%	0.395	S	S	.	.			trans	-109.9	82.6	176.2	-170.4	10.4	0	0	0	111.4	K468 C472 K473 N485	K468-D470 PolarHBondContact O-N 2.94Å; D470-C472 PolarHBondContact O-N 2.67Å; D470-C472 VanDerWaalsContact O-N 3.09Å; D470-C472 PolarHBondContact OD1-N 3.42Å; D470-K473 HydrophobicContact CB-CD 4Å; D470-K473 HydrophobicContact CB-CG 4.13Å; D470-K473 PolarHBondContact O-N 3.46Å; D470-K473 VanDerWaalsContact O-N 3.08Å; D470-K473 WeakPolarHBondContact OD2-CE 3.33Å; D470-N485 PolarHBondContact OD1-ND2 3.02Å
471	H	78.2	Confident	84.6	Confident	48 Å²	48	75.9 Å²	75.9	22%	0.222	38%	0.383	C	S	.	.	G	3₁₀ helix	trans	-62.3	-14.9	179.9	-64.6	-71.1	0	0	0	113.3	K473 N485 L486 G489 Y490	H471-K473 VanDerWaalsContact C-N 3.32Å; H471-N485 WeakPolarHBondContact CB-OD1 3.02Å; H471-N485 PolarHBondContact CD2-OD1 3.18Å; H471-N485 PolarHBondContact N-OD1 3.28Å; H471-L486 PolarHBondContact CD2-O 3.16Å; H471-G489 WeakPolarHBondContact CB-O 3.5Å; H471-G489 VanDerWaalsContact CD2-CA 3.45Å; H471-G489 WeakPolarHBondContact CD2-CA 3.44Å; H471-G489 PolarHBondContact CD2-N 3.33Å; H471-G489 PolarHBondContact CD2-O 2.85Å; H471-G489 VanDerWaalsContact CG-CA 3.46Å; H471-G489 PolarHBondContact NE2-N 2.79Å; H471-Y490 HydrophobicContact CB-CD1 4.14Å; H471-Y490 WeakPolarHBondContact O-CD1 3.24Å
472	C	84.8	Confident	85.1	Confident	27 Å²	27	76 Å²	76	18%	0.182	39%	0.39	C	S	.	.	G	3₁₀ helix	trans	-78.2	-9.6	174.6	-72.4	0	0	0	0	114.3	D470 S474 H475 C483 N485	D470-C472 PolarHBondContact O-N 2.67Å; D470-C472 VanDerWaalsContact O-N 3.09Å; D470-C472 PolarHBondContact OD1-N 3.42Å; C472-S474 PolarHBondContact O-N 2.03Å; C472-H475 PolarHBondContact O-CD2 2.79Å; C472-C483 WeakPolarHBondContact CA-SG 3.49Å; C472-C483 HydrophobicContact CB-CB 3.91Å; C472-C483 WeakPolarHBondContact CB-SG 3.02Å; C472-C483 VanDerWaalsContact SG-C 3.51Å; C472-C483 WeakPolarHBondContact SG-CB 3.38Å; C472-C483 CovalentContact SG-SG 2.04Å; C472-C483 PolarHBondContact SG-SG 3.07Å; C472-N485 PolarHBondContact SG-N 2.78Å; C472-N485 VanDerWaalsContact SG-N 3.36Å
473	K	82.4	Confident	85.4	Confident	165 Å²	165	75.3 Å²	75.3	72%	0.717	38%	0.379	S	S	*	.	G	3₁₀ helix	trans	-68.8	-18.7	174.5	-71.4	174.6	-176	162.7	0	113.8	D470 H471	D470-K473 HydrophobicContact CB-CD 4Å; D470-K473 HydrophobicContact CB-CG 4.13Å; D470-K473 PolarHBondContact O-N 3.46Å; D470-K473 VanDerWaalsContact O-N 3.08Å; D470-K473 WeakPolarHBondContact OD2-CE 3.33Å; H471-K473 VanDerWaalsContact C-N 3.32Å
474	S	77.7	Confident	85.3	Confident	93 Å²	93	73.2 Å²	73.2	65%	0.65	37%	0.368	S	S	*	.	G	3₁₀ helix	trans	-134.9	44.5	179.5	65	0	0	0	0	110.6	C472	C472-S474 PolarHBondContact O-N 2.03Å
475	H	81.7	Confident	84.7	Confident	81 Å²	81	72.1 Å²	72.1	38%	0.375	37%	0.365	S	S	.	.			trans	-80	146.1	179.2	71.8	58.7	0	0	0	112.1	C472 C477 C483 Y490	C472-H475 PolarHBondContact O-CD2 2.79Å; H475-C477 PolarHBondContact ND1-N 2.03Å; H475-C483 HydrophobicContact CB-CB 4.07Å; H475-C483 VanDerWaalsContact CB-SG 3.57Å; H475-C483 WeakPolarHBondContact CD2-CB 3.04Å; H475-Y490 HydrophobicContact CB-CD2 3.84Å; H475-Y490 HydrophobicContact CB-CE1 4.44Å; H475-Y490 HydrophobicContact CB-CE2 3.69Å; H475-Y490 HydrophobicContact CB-CG 4.29Å
476	E	87.1	Confident	83.8	Confident	133 Å²	133	75.5 Å²	75.5	62%	0.621	38%	0.382	S	S	*	.			trans	-101.3	17.5	177.1	-59.3	175.4	158.4	0	0	111.2	E478 Y490 F502	E476-E478 PolarHBondContact O-N 3.3Å; E476-Y490 WeakPolarHBondContact CB-OH 3.16Å; E476-Y490 PolarHBondContact N-OH 3.1Å; E476-F502 HydrophobicContact CB-CD1 4.33Å
477	C	89	Confident	82.6	Confident	16 Å²	16	75.6 Å²	75.6	11%	0.108	39%	0.389	C	S	.	.			trans	-60.7	106.4	177.2	-53.6	0	0	0	0	112.1	H475 G481 C492 F502	H475-C477 PolarHBondContact ND1-N 2.03Å; C477-G481 WeakPolarHBondContact CB-O 3.41Å; C477-C492 WeakPolarHBondContact CA-SG 3.18Å; C477-C492 HydrophobicContact CB-CB 3.79Å; C477-C492 WeakPolarHBondContact CB-SG 3.3Å; C477-C492 VanDerWaalsContact SG-CA 3.6Å; C477-C492 WeakPolarHBondContact SG-CB 3.2Å; C477-C492 CovalentContact SG-SG 2.03Å; C477-C492 PolarHBondContact SG-SG 3.01Å; C477-F502 CarbonylContact C-O 3.55Å; C477-F502 VanDerWaalsContact CA-O 3.29Å; C477-F502 WeakPolarHBondContact CA-O 3.4Å
478	E	87.5	Confident	81.6	Confident	121 Å²	121	77.2 Å²	77.2	57%	0.565	40%	0.396	S	S	*	.			trans	-85.8	-179.3	176.1	-67.6	-149.2	-164.6	0	0	112.2	E476 E480 G481 F502 C503	E476-E478 PolarHBondContact O-N 3.3Å; E478-E480 PolarHBondContact O-N 2.78Å; E478-G481 PolarHBondContact O-N 3.24Å; E478-F502 PolarHBondContact N-O 3.09Å; E478-C503 WeakPolarHBondContact O-CB 3.36Å
479	N	86.6	Confident	81	Confident	43 Å²	43	72.4 Å²	72.4	23%	0.23	38%	0.381	C	S	.	.	T	Hydrogen-bonded Turn	trans	49.9	30.5	172.2	-72.5	-57.3	0	0	0	116.8	G481 P495 Y497 A498 C503 E504	N479-G481 VanDerWaalsContact C-N 3.32Å; N479-P495 WeakPolarHBondContact O-CG 3.39Å; N479-Y497 HydrophobicContact CB-CE2 4.27Å; N479-Y497 PolarHBondContact O-OH 2.76Å; N479-A498 HydrophobicContact CB-CB 3.98Å; N479-C503 WeakPolarHBondContact CB-O 3.05Å; N479-C503 PolarHBondContact ND2-O 2.97Å; N479-E504 PolarHBondContact ND2-O 3.22Å
480	E	86.9	Confident	81.2	Confident	141 Å²	141	72.7 Å²	72.7	66%	0.659	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.6	21.9	-175.6	-59.5	152.8	-144.8	0	0	114.3	E478 T482 Y497 K525	E478-E480 PolarHBondContact O-N 2.78Å; E480-T482 PolarHBondContact O-N 3.13Å; E480-Y497 PolarHBondContact OE2-OH 3.32Å; E480-K525 IonicContact OE1-NZ 3.93Å; E480-K525 PolarHBondContact OE1-NZ 3.35Å; E480-K525 IonicContact OE2-NZ 2.67Å
481	G	88.7	Confident	81.4	Confident	7 Å²	7	71.9 Å²	71.9	7%	0.072	38%	0.382	C	S	.	.			trans	-58.2	127.3	172.2	0	0	0	0	0	112.6	C477 E478 N479 C483	C477-G481 WeakPolarHBondContact CB-O 3.41Å; E478-G481 PolarHBondContact O-N 3.24Å; N479-G481 VanDerWaalsContact C-N 3.32Å; G481-C483 PolarHBondContact O-N 3.38Å
482	T	90.9	Very high	81.9	Confident	91 Å²	91	70.5 Å²	70.5	56%	0.558	38%	0.377	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.4	113.9	-179.7	-58.6	0	0	0	0	110.3	E480 K493	E480-T482 PolarHBondContact O-N 3.13Å; T482-K493 PolarHBondContact N-O 3.16Å; T482-K493 WeakPolarHBondContact O-CB 3.24Å; T482-K493 PolarHBondContact O-N 3.03Å
483	C	90	Very high	82.2	Confident	25 Å²	25	75.8 Å²	75.8	17%	0.169	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	136.8	177.4	-175.3	0	0	0	0	112.9	C472 H475 G481 Y490	C472-C483 WeakPolarHBondContact CA-SG 3.49Å; C472-C483 HydrophobicContact CB-CB 3.91Å; C472-C483 WeakPolarHBondContact CB-SG 3.02Å; C472-C483 VanDerWaalsContact SG-C 3.51Å; C472-C483 WeakPolarHBondContact SG-CB 3.38Å; C472-C483 CovalentContact SG-SG 2.04Å; C472-C483 PolarHBondContact SG-SG 3.07Å; H475-C483 HydrophobicContact CB-CB 4.07Å; H475-C483 VanDerWaalsContact CB-SG 3.57Å; H475-C483 WeakPolarHBondContact CD2-CB 3.04Å; G481-C483 PolarHBondContact O-N 3.38Å; C483-Y490 VanDerWaalsContact SG-CB 3.59Å
484	I	86.7	Confident	82.5	Confident	81 Å²	81	69.7 Å²	69.7	42%	0.415	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	115.4	173.2	-57	177.9	0	0	0	108.2	L486 Y490 A491 K493	I484-L486 HydrophobicContact CG2-CD2 4.11Å; I484-Y490 VanDerWaalsContact O-CA 3.3Å; I484-Y490 WeakPolarHBondContact O-CA 3.41Å; I484-A491 PolarHBondContact N-O 3.43Å; I484-A491 PolarHBondContact O-N 2.76Å; I484-K493 HydrophobicContact CD1-CB 4.08Å
485	N	78.2	Confident	83	Confident	41 Å²	41	67 Å²	67	22%	0.219	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	123.3	178.6	-178.6	26.1	0	0	0	110.8	I469 D470 H471 C472	I469-N485 PolarHBondContact O-ND2 2.92Å; I469-N485 PolarHBondContact O-OD1 3.41Å; D470-N485 PolarHBondContact OD1-ND2 3.02Å; H471-N485 WeakPolarHBondContact CB-OD1 3.02Å; H471-N485 PolarHBondContact CD2-OD1 3.18Å; H471-N485 PolarHBondContact N-OD1 3.28Å; C472-N485 PolarHBondContact SG-N 2.78Å; C472-N485 VanDerWaalsContact SG-N 3.36Å
486	L	70.9	Confident	83.3	Confident	70 Å²	70	72.6 Å²	72.6	37%	0.366	38%	0.381	S	S	.	.			trans	-115.9	167.8	-176.2	-62.4	176.4	0	0	0	110.8	H471 I484 H488 G489 A491	H471-L486 PolarHBondContact CD2-O 3.16Å; I484-L486 HydrophobicContact CG2-CD2 4.11Å; L486-H488 PolarHBondContact O-N 2.84Å; L486-H488 VanDerWaalsContact O-N 3.15Å; L486-G489 CarbonylContact C-O 3.31Å; L486-G489 WeakPolarHBondContact CA-O 2.95Å; L486-G489 WeakPolarHBondContact CB-O 3.47Å; L486-G489 PolarHBondContact N-O 3.41Å; L486-G489 VanDerWaalsContact O-O 3.1Å; L486-A491 HydrophobicContact CD1-CB 3.81Å
487	P	63.7	Low	83.2	Confident	73 Å²	73	68.3 Å²	68.3	47%	0.474	36%	0.36	S	S	.	.	S	Bend	trans	-65	-12.4	173.7	-22	34.7	0	0	0	114.5
488	H	63.7	Low	83.2	Confident	141 Å²	141	67.9 Å²	67.9	65%	0.653	36%	0.358	S	S	*	.	S	Bend	trans	-136.9	72.4	-176.2	-57	-32.1	0	0	0	109.4	L486	L486-H488 PolarHBondContact O-N 2.84Å; L486-H488 VanDerWaalsContact O-N 3.15Å
489	G	69.8	Low	83.1	Confident	21 Å²	21	65.5 Å²	65.5	22%	0.216	35%	0.352	C	S	.	.	S	Bend	trans	82.5	-149.8	-176	0	0	0	0	0	113	H471 L486	H471-G489 WeakPolarHBondContact CB-O 3.5Å; H471-G489 VanDerWaalsContact CD2-CA 3.45Å; H471-G489 WeakPolarHBondContact CD2-CA 3.44Å; H471-G489 PolarHBondContact CD2-N 3.33Å; H471-G489 PolarHBondContact CD2-O 2.85Å; H471-G489 VanDerWaalsContact CG-CA 3.46Å; H471-G489 PolarHBondContact NE2-N 2.79Å; L486-G489 CarbonylContact C-O 3.31Å; L486-G489 WeakPolarHBondContact CA-O 2.95Å; L486-G489 WeakPolarHBondContact CB-O 3.47Å; L486-G489 PolarHBondContact N-O 3.41Å; L486-G489 VanDerWaalsContact O-O 3.1Å
490	Y	81.1	Confident	83	Confident	49 Å²	49	65 Å²	65	19%	0.192	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	163.7	179.9	64.4	-84.8	0	0	0	110.6	H471 H475 E476 C483 I484 F502	H471-Y490 HydrophobicContact CB-CD1 4.14Å; H471-Y490 WeakPolarHBondContact O-CD1 3.24Å; H475-Y490 HydrophobicContact CB-CD2 3.84Å; H475-Y490 HydrophobicContact CB-CE1 4.44Å; H475-Y490 HydrophobicContact CB-CE2 3.69Å; H475-Y490 HydrophobicContact CB-CG 4.29Å; E476-Y490 WeakPolarHBondContact CB-OH 3.16Å; E476-Y490 PolarHBondContact N-OH 3.1Å; C483-Y490 VanDerWaalsContact SG-CB 3.59Å; I484-Y490 VanDerWaalsContact O-CA 3.3Å; I484-Y490 WeakPolarHBondContact O-CA 3.41Å; Y490-F502 AromaticContact CE2-CD1 3.88Å; Y490-F502 HydrophobicContact CE2-CD1 3.88Å; Y490-F502 AromaticContact CE2-CE1 3.87Å; Y490-F502 HydrophobicContact CE2-CE1 3.87Å; Y490-F502 AromaticContact CZ-CE1 3.77Å; Y490-F502 WeakPolarHBondContact OH-CE1 3.37Å
491	A	83.8	Confident	82.9	Confident	42 Å²	42	64.3 Å²	64.3	35%	0.347	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	139.7	169.8	0	0	0	0	0	110	I484 L486	I484-A491 PolarHBondContact N-O 3.43Å; I484-A491 PolarHBondContact O-N 2.76Å; L486-A491 HydrophobicContact CD1-CB 3.81Å
492	C	88.9	Confident	82.9	Confident	19 Å²	19	67.6 Å²	67.6	13%	0.128	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	123.2	177.8	-56.7	0	0	0	0	110.1	C477	C477-C492 WeakPolarHBondContact CA-SG 3.18Å; C477-C492 HydrophobicContact CB-CB 3.79Å; C477-C492 WeakPolarHBondContact CB-SG 3.3Å; C477-C492 VanDerWaalsContact SG-CA 3.6Å; C477-C492 WeakPolarHBondContact SG-CB 3.2Å; C477-C492 CovalentContact SG-SG 2.03Å; C477-C492 PolarHBondContact SG-SG 3.01Å
493	K	91.2	Very high	82.7	Confident	139 Å²	139	63.3 Å²	63.3	60%	0.604	34%	0.343	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.2	103.4	169.5	-176.4	-168.8	174.1	-169.9	0	109	T482 I484	T482-K493 PolarHBondContact N-O 3.16Å; T482-K493 WeakPolarHBondContact O-CB 3.24Å; T482-K493 PolarHBondContact O-N 3.03Å; I484-K493 HydrophobicContact CD1-CB 4.08Å
494	C	89.1	Confident	82.6	Confident	37 Å²	37	65.6 Å²	65.6	25%	0.25	35%	0.351	C	S	.	.			trans	-71.9	148.4	-178	-49.7	0	0	0	0	112.8	A498 C503	C494-A498 HydrophobicContact CB-CB 4.33Å; C494-A498 WeakPolarHBondContact CB-O 3.31Å; C494-C503 WeakPolarHBondContact CA-SG 3.03Å; C494-C503 HydrophobicContact CB-CB 3.81Å; C494-C503 WeakPolarHBondContact CB-SG 3.43Å; C494-C503 PolarHBondContact N-SG 3.43Å; C494-C503 VanDerWaalsContact N-SG 3.44Å; C494-C503 WeakPolarHBondContact SG-CA 3.19Å; C494-C503 WeakPolarHBondContact SG-CB 3.36Å; C494-C503 CovalentContact SG-SG 2.04Å; C494-C503 PolarHBondContact SG-SG 2.9Å
495	P	86.7	Confident	82.5	Confident	36 Å²	36	66.2 Å²	66.2	23%	0.234	36%	0.356	C	S	.	.			trans	-70.9	165.7	165.5	31.4	-35.3	0	0	0	111.2	N479 Y497 A498	N479-P495 WeakPolarHBondContact O-CG 3.39Å; P495-Y497 HydrophobicContact CB-CD1 4.13Å; P495-Y497 HydrophobicContact CB-CE1 3.69Å; P495-Y497 HydrophobicContact CB-CE2 4.37Å; P495-Y497 HydrophobicContact CG-CD1 4.28Å; P495-Y497 HydrophobicContact CG-CD2 4.13Å; P495-Y497 HydrophobicContact CG-CE1 3.73Å; P495-Y497 HydrophobicContact CG-CE2 3.52Å; P495-Y497 HydrophobicContact CG-CG 4.46Å; P495-Y497 WeakPolarHBondContact CG-OH 3.02Å; P495-Y497 PolarHBondContact O-N 3.06Å; P495-A498 HydrophobicContact CG-CB 4.23Å; P495-A498 PolarHBondContact O-N 3.09Å
496	E	87.8	Confident	82.7	Confident	198 Å²	198	67.1 Å²	67.1	93%	0.925	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-4.1	-171.8	-59	-178.1	155.4	0	0	115.9
497	Y	86.6	Confident	83.3	Confident	43 Å²	43	67 Å²	67	17%	0.169	36%	0.359	C	S	.	.	T	Hydrogen-bonded Turn	trans	-112.5	-0.7	179.9	59.6	-107.7	0	0	0	114.3	N479 E480 P495 L506 I507 K525	N479-Y497 HydrophobicContact CB-CE2 4.27Å; N479-Y497 PolarHBondContact O-OH 2.76Å; E480-Y497 PolarHBondContact OE2-OH 3.32Å; P495-Y497 HydrophobicContact CB-CD1 4.13Å; P495-Y497 HydrophobicContact CB-CE1 3.69Å; P495-Y497 HydrophobicContact CB-CE2 4.37Å; P495-Y497 HydrophobicContact CG-CD1 4.28Å; P495-Y497 HydrophobicContact CG-CD2 4.13Å; P495-Y497 HydrophobicContact CG-CE1 3.73Å; P495-Y497 HydrophobicContact CG-CE2 3.52Å; P495-Y497 HydrophobicContact CG-CG 4.46Å; P495-Y497 WeakPolarHBondContact CG-OH 3.02Å; P495-Y497 PolarHBondContact O-N 3.06Å; Y497-L506 HydrophobicContact CD2-CD2 3.89Å; Y497-L506 HydrophobicContact CE2-CD2 4.38Å; Y497-I507 PolarHBondContact O-N 3.32Å; Y497-K525 HydrophobicContact CD2-CG 3.86Å; Y497-K525 HydrophobicContact CE2-CD 4.17Å; Y497-K525 VanDerWaalsContact CE2-CE 3.42Å; Y497-K525 HydrophobicContact CE2-CG 3.83Å; Y497-K525 HydrophobicContact CG-CG 4.33Å; Y497-K525 WeakPolarHBondContact OH-CE 3.39Å; Y497-K525 PolarHBondContact OH-NZ 2.86Å
498	A	87.8	Confident	84.1	Confident	8 Å²	8	68.2 Å²	68.2	7%	0.066	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	153.8	-175.5	0	0	0	0	0	112.4	N479 C494 P495 C503 D505	N479-A498 HydrophobicContact CB-CB 3.98Å; C494-A498 HydrophobicContact CB-CB 4.33Å; C494-A498 WeakPolarHBondContact CB-O 3.31Å; P495-A498 HydrophobicContact CG-CB 4.23Å; P495-A498 PolarHBondContact O-N 3.09Å; A498-C503 HydrophobicContact CB-CB 4.26Å; A498-D505 CarbonylContact C-O 3.39Å; A498-D505 VanDerWaalsContact CA-O 3.25Å; A498-D505 WeakPolarHBondContact CA-O 3.34Å
499	T	85.7	Confident	85	Confident	71 Å²	71	63.9 Å²	63.9	44%	0.436	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	179.8	-175.8	-168.5	0	0	0	0	110.6	C503 E504 D505 I507	T499-C503 CarbonylContact O-C 3.58Å; T499-C503 VanDerWaalsContact O-CA 3.27Å; T499-C503 WeakPolarHBondContact O-CA 3.49Å; T499-E504 PolarHBondContact O-N 2.98Å; T499-D505 HydrophobicContact CG2-CB 3.66Å; T499-D505 PolarHBondContact N-O 2.81Å; T499-D505 PolarHBondContact O-N 2.82Å; T499-D505 VanDerWaalsContact O-N 3.1Å; T499-I507 HydrophobicContact CG2-CG1 4.06Å
500	G	84.8	Confident	85.7	Confident	31 Å²	31	64 Å²	64	32%	0.32	34%	0.34	S	S	.	.	S	Bend	trans	94.9	-179.9	-168.9	0	0	0	0	0	112.7	E504	G500-E504 VanDerWaalsContact CA-OE2 3.24Å; G500-E504 WeakPolarHBondContact CA-OE2 3.2Å
501	N	85.7	Confident	85.7	Confident	128 Å²	128	70.2 Å²	70.2	68%	0.684	37%	0.371	S	S	*	.	S	Bend	trans	-82.4	-25.8	-176.7	-67.6	-61.2	0	0	0	112.8	E504	N501-E504 PolarHBondContact N-OE1 2.03Å; N501-E504 PolarHBondContact N-OE2 2.9Å
502	F	87.4	Confident	85.5	Confident	76 Å²	76	71.9 Å²	71.9	33%	0.333	37%	0.374	S	S	.	.	S	Bend	trans	-115.2	9.3	-179.4	-55.8	-72.3	0	0	0	112	E476 C477 E478 Y490 E504	E476-F502 HydrophobicContact CB-CD1 4.33Å; C477-F502 CarbonylContact C-O 3.55Å; C477-F502 VanDerWaalsContact CA-O 3.29Å; C477-F502 WeakPolarHBondContact CA-O 3.4Å; E478-F502 PolarHBondContact N-O 3.09Å; Y490-F502 AromaticContact CE2-CD1 3.88Å; Y490-F502 HydrophobicContact CE2-CD1 3.88Å; Y490-F502 AromaticContact CE2-CE1 3.87Å; Y490-F502 HydrophobicContact CE2-CE1 3.87Å; Y490-F502 AromaticContact CZ-CE1 3.77Å; Y490-F502 WeakPolarHBondContact OH-CE1 3.37Å; F502-E504 VanDerWaalsContact C-OE2 3.25Å; F502-E504 VanDerWaalsContact CA-OE2 3.28Å; F502-E504 WeakPolarHBondContact CA-OE2 3.01Å; F502-E504 PolarHBondContact N-OE2 3.29Å; F502-E504 PolarHBondContact O-N 2.73Å
503	C	87.8	Confident	84.8	Confident	0 Å²	0	79.8 Å²	79.8	0%	0	41%	0.409	C	S	.	.	S	Bend	trans	63.1	28.2	-173.6	-43.5	0	0	0	0	113.1	E478 N479 C494 A498 T499	E478-C503 WeakPolarHBondContact O-CB 3.36Å; N479-C503 WeakPolarHBondContact CB-O 3.05Å; N479-C503 PolarHBondContact ND2-O 2.97Å; C494-C503 WeakPolarHBondContact CA-SG 3.03Å; C494-C503 HydrophobicContact CB-CB 3.81Å; C494-C503 WeakPolarHBondContact CB-SG 3.43Å; C494-C503 PolarHBondContact N-SG 3.43Å; C494-C503 VanDerWaalsContact N-SG 3.44Å; C494-C503 WeakPolarHBondContact SG-CA 3.19Å; C494-C503 WeakPolarHBondContact SG-CB 3.36Å; C494-C503 CovalentContact SG-SG 2.04Å; C494-C503 PolarHBondContact SG-SG 2.9Å; A498-C503 HydrophobicContact CB-CB 4.26Å; T499-C503 CarbonylContact O-C 3.58Å; T499-C503 VanDerWaalsContact O-CA 3.27Å; T499-C503 WeakPolarHBondContact O-CA 3.49Å
504	E	87.6	Confident	84.2	Confident	74 Å²	74	78.4 Å²	78.4	35%	0.346	41%	0.408	S	S	.	.			trans	-63.9	-38.6	-178.7	59.7	-85.7	-137	0	0	112.5	N479 T499 G500 N501 F502	N479-E504 PolarHBondContact ND2-O 3.22Å; T499-E504 PolarHBondContact O-N 2.98Å; G500-E504 VanDerWaalsContact CA-OE2 3.24Å; G500-E504 WeakPolarHBondContact CA-OE2 3.2Å; N501-E504 PolarHBondContact N-OE1 2.03Å; N501-E504 PolarHBondContact N-OE2 2.9Å; F502-E504 VanDerWaalsContact C-OE2 3.25Å; F502-E504 VanDerWaalsContact CA-OE2 3.28Å; F502-E504 WeakPolarHBondContact CA-OE2 3.01Å; F502-E504 PolarHBondContact N-OE2 3.29Å; F502-E504 PolarHBondContact O-N 2.73Å
505	D	84.3	Confident	84	Confident	94 Å²	94	77.7 Å²	77.7	50%	0.503	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	138.7	-175.3	-69.7	-46.5	0	0	0	111.8	A498 T499	A498-D505 CarbonylContact C-O 3.39Å; A498-D505 VanDerWaalsContact CA-O 3.25Å; A498-D505 WeakPolarHBondContact CA-O 3.34Å; T499-D505 HydrophobicContact CG2-CB 3.66Å; T499-D505 PolarHBondContact N-O 2.81Å; T499-D505 PolarHBondContact O-N 2.82Å; T499-D505 VanDerWaalsContact O-N 3.1Å
506	L	82.7	Confident	84	Confident	60 Å²	60	76.1 Å²	76.1	31%	0.314	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	135	161.4	-67.2	178.2	0	0	0	109	Y497 D508 K525	Y497-L506 HydrophobicContact CD2-CD2 3.89Å; Y497-L506 HydrophobicContact CE2-CD2 4.38Å; L506-D508 PolarHBondContact O-N 3.14Å; L506-K525 HydrophobicContact CD1-CB 4.29Å; L506-K525 HydrophobicContact CD2-CB 4.37Å; L506-K525 HydrophobicContact CD2-CG 4.3Å
507	I	82.4	Confident	83.8	Confident	68 Å²	68	68.2 Å²	68.2	35%	0.349	36%	0.363	S	S	.	.	P	Polyproline II helix	trans	-56.9	133.5	174.8	-70.5	168	0	0	0	108.8	Y497 T499 N509 N523	Y497-I507 PolarHBondContact O-N 3.32Å; T499-I507 HydrophobicContact CG2-CG1 4.06Å; I507-N509 PolarHBondContact O-N 3.41Å; I507-N509 VanDerWaalsContact O-N 3.15Å; I507-N509 PolarHBondContact O-ND2 2.03Å; I507-N523 PolarHBondContact O-ND2 3.25Å; I507-N523 PolarHBondContact O-OD1 3.21Å
508	D	81.7	Confident	83.8	Confident	98 Å²	98	70.8 Å²	70.8	52%	0.524	38%	0.377	S	S	.	.			trans	-78.6	102.4	-177.4	-164.5	1.3	0	0	0	111.7	L506 C510 N523	L506-D508 PolarHBondContact O-N 3.14Å; D508-C510 PolarHBondContact O-N 2.89Å; D508-C510 VanDerWaalsContact OD1-CB 3.3Å; D508-C510 WeakPolarHBondContact OD1-CB 3.41Å; D508-C510 PolarHBondContact OD1-N 2.63Å; D508-N523 WeakPolarHBondContact CA-ND2 3.24Å
509	N	82.4	Confident	83.7	Confident	50 Å²	50	71.3 Å²	71.3	27%	0.267	38%	0.383	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.8	9.3	176.1	-56.7	-86.1	0	0	0	112.4	I507 Q515 N523 G527 Y528	I507-N509 PolarHBondContact O-N 3.41Å; I507-N509 VanDerWaalsContact O-N 3.15Å; I507-N509 PolarHBondContact O-ND2 2.03Å; N509-Q515 PolarHBondContact O-NE2 3.45Å; N509-N523 WeakPolarHBondContact CB-OD1 3.38Å; N509-N523 PolarHBondContact N-OD1 2.03Å; N509-N523 VanDerWaalsContact N-OD1 3.09Å; N509-N523 PolarHBondContact ND2-OD1 2.85Å; N509-G527 PolarHBondContact ND2-N 2.83Å; N509-G527 PolarHBondContact ND2-O 3.27Å; N509-Y528 HydrophobicContact CB-CD1 4.18Å; N509-Y528 WeakPolarHBondContact O-CD1 3.44Å
510	C	84.6	Confident	83.8	Confident	23 Å²	23	75.9 Å²	75.9	16%	0.155	39%	0.393	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107.2	13.5	178.3	-68.9	0	0	0	0	115	D508 D512 C521 N523	D508-C510 PolarHBondContact O-N 2.89Å; D508-C510 VanDerWaalsContact OD1-CB 3.3Å; D508-C510 WeakPolarHBondContact OD1-CB 3.41Å; D508-C510 PolarHBondContact OD1-N 2.63Å; C510-D512 VanDerWaalsContact C-N 3.29Å; C510-D512 PolarHBondContact O-N 3.29Å; C510-C521 VanDerWaalsContact CA-SG 3.53Å; C510-C521 HydrophobicContact CB-CB 3.71Å; C510-C521 WeakPolarHBondContact CB-SG 3.03Å; C510-C521 WeakPolarHBondContact SG-CB 3.43Å; C510-C521 CovalentContact SG-SG 2.04Å; C510-C521 PolarHBondContact SG-SG 2.99Å; C510-N523 PolarHBondContact SG-N 3.22Å
511	E	80.5	Confident	84	Confident	179 Å²	179	75.3 Å²	75.3	84%	0.836	39%	0.385	S	S	*	.			trans	-60.7	-28.5	-176.2	-166.7	179.2	-156.8	0	0	114.5	E513	E511-E513 PolarHBondContact O-N 3.26Å
512	D	80.5	Confident	84.1	Confident	77 Å²	77	75 Å²	75	41%	0.412	37%	0.374	S	S	.	.			trans	-85.6	101.2	170.7	176.7	18.3	0	0	0	111.4	C510 N514 Q515	C510-D512 VanDerWaalsContact C-N 3.29Å; C510-D512 PolarHBondContact O-N 3.29Å; D512-N514 PolarHBondContact O-N 2.95Å; D512-N514 WeakPolarHBondContact OD1-CB 3.47Å; D512-N514 PolarHBondContact OD1-N 3.06Å; D512-N514 PolarHBondContact OD1-ND2 2.9Å; D512-Q515 HydrophobicContact CB-CB 4.14Å; D512-Q515 WeakPolarHBondContact O-CG 3.45Å; D512-Q515 PolarHBondContact O-N 3.32Å; D512-Q515 PolarHBondContact OD2-N 3.03Å
513	E	73	Confident	83.9	Confident	185 Å²	185	73.7 Å²	73.7	86%	0.864	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.7	-25.8	173.6	-63	-174.8	149.4	0	0	113.7	E511	E511-E513 PolarHBondContact O-N 3.26Å
514	N	78.6	Confident	83.5	Confident	110 Å²	110	78.4 Å²	78.4	59%	0.588	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.4	-6.9	-175.5	-58	-92.9	0	0	0	113.5	D512 C516 G517 R542	D512-N514 PolarHBondContact O-N 2.95Å; D512-N514 WeakPolarHBondContact OD1-CB 3.47Å; D512-N514 PolarHBondContact OD1-N 3.06Å; D512-N514 PolarHBondContact OD1-ND2 2.9Å; N514-C516 PolarHBondContact O-N 2.83Å; N514-G517 PolarHBondContact O-N 2.87Å; N514-R542 PolarHBondContact O-NH2 2.75Å
515	Q	85.4	Confident	83	Confident	22 Å²	22	79.7 Å²	79.7	10%	0.103	40%	0.395	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-30.7	-173.8	78.1	-179.2	-2.7	0	0	112.6	N509 D512 C521 Y528 N540	N509-Q515 PolarHBondContact O-NE2 3.45Å; D512-Q515 HydrophobicContact CB-CB 4.14Å; D512-Q515 WeakPolarHBondContact O-CG 3.45Å; D512-Q515 PolarHBondContact O-N 3.32Å; D512-Q515 PolarHBondContact OD2-N 3.03Å; Q515-C521 PolarHBondContact NE2-SG 2.91Å; Q515-Y528 HydrophobicContact CG-CE2 4.17Å; Q515-Y528 VanDerWaalsContact NE2-CD1 3.34Å; Q515-Y528 VanDerWaalsContact NE2-CG 3.28Å; Q515-N540 WeakPolarHBondContact O-CB 3.47Å; Q515-N540 PolarHBondContact O-ND2 3.15Å
516	C	86.8	Confident	82.7	Confident	3 Å²	3	78 Å²	78	2%	0.02	40%	0.399	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.1	12.5	179.2	-68.5	0	0	0	0	115.1	N514 Q518 G519 C521 C530 N540 C541	N514-C516 PolarHBondContact O-N 2.83Å; C516-Q518 CarbonylContact O-C 3.01Å; C516-Q518 PolarHBondContact O-N 3.27Å; C516-G519 WeakPolarHBondContact CB-O 3.27Å; C516-G519 PolarHBondContact O-N 2.64Å; C516-G519 VanDerWaalsContact O-N 3.15Å; C516-C521 HydrophobicContact CB-CB 4.4Å; C516-C521 VanDerWaalsContact SG-CB 3.52Å; C516-C530 WeakPolarHBondContact CA-SG 3.45Å; C516-C530 HydrophobicContact CB-CB 3.59Å; C516-C530 WeakPolarHBondContact CB-SG 3.27Å; C516-C530 VanDerWaalsContact SG-CA 3.51Å; C516-C530 WeakPolarHBondContact SG-CB 3.48Å; C516-C530 CovalentContact SG-SG 2.03Å; C516-C530 PolarHBondContact SG-SG 3.27Å; C516-N540 CarbonylContact C-O 3.59Å; C516-N540 WeakPolarHBondContact CA-O 3.44Å; C516-N540 VanDerWaalsContact O-O 3.09Å; C516-C541 WeakPolarHBondContact O-CB 3.24Å
517	G	84.5	Confident	82.6	Confident	33 Å²	33	76 Å²	76	34%	0.34	39%	0.394	S	S	.	.	S	Bend	trans	59.7	-101.3	163.3	0	0	0	0	0	114.5	N514 N540	N514-G517 PolarHBondContact O-N 2.87Å; G517-N540 PolarHBondContact N-O 3.09Å
518	Q	84.8	Confident	82.8	Confident	96 Å²	96	77 Å²	77	45%	0.449	39%	0.394	S	S	.	.	S	Bend	trans	-118.7	75.9	171.2	-63	-70.1	-95	0	0	108.9	C516 D533 Y536 C541	C516-Q518 CarbonylContact O-C 3.01Å; C516-Q518 PolarHBondContact O-N 3.27Å; Q518-D533 PolarHBondContact O-N 3.47Å; Q518-Y536 HydrophobicContact CB-CD1 3.92Å; Q518-Y536 HydrophobicContact CB-CD2 3.49Å; Q518-Y536 VanDerWaalsContact CB-CD2 3.49Å; Q518-Y536 HydrophobicContact CB-CE1 3.97Å; Q518-Y536 HydrophobicContact CB-CE2 3.53Å; Q518-Y536 HydrophobicContact CB-CG 3.69Å; Q518-Y536 HydrophobicContact CG-CD1 4.29Å; Q518-Y536 HydrophobicContact CG-CD2 4.27Å; Q518-Y536 HydrophobicContact CG-CE1 3.85Å; Q518-Y536 HydrophobicContact CG-CE2 3.82Å; Q518-Y536 HydrophobicContact CG-CG 4.48Å; Q518-C541 PolarHBondContact N-O 2.03Å; Q518-C541 VanDerWaalsContact O-CB 3.27Å; Q518-C541 WeakPolarHBondContact O-CB 3Å
519	G	86.1	Confident	83.1	Confident	19 Å²	19	74.5 Å²	74.5	20%	0.196	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	175.3	159	-177.5	0	0	0	0	0	112.2	C516 I531 D533	C516-G519 WeakPolarHBondContact CB-O 3.27Å; C516-G519 PolarHBondContact O-N 2.64Å; C516-G519 VanDerWaalsContact O-N 3.15Å; G519-I531 CarbonylContact C-O 3.34Å; G519-I531 WeakPolarHBondContact CA-O 3.43Å; G519-D533 PolarHBondContact N-OD2 2.84Å
520	Y	87.9	Confident	83.4	Confident	167 Å²	167	73.1 Å²	73.1	66%	0.655	37%	0.373	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.8	136.6	-179.2	175.7	-98.8	0	0	0	112.1	I531	Y520-I531 PolarHBondContact N-O 3.31Å; Y520-I531 PolarHBondContact O-N 2.97Å
521	C	88.8	Confident	83.6	Confident	20 Å²	20	75.7 Å²	75.7	14%	0.135	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	126.2	176.2	-169.9	0	0	0	0	112.2	C510 Q515 C516	C510-C521 VanDerWaalsContact CA-SG 3.53Å; C510-C521 HydrophobicContact CB-CB 3.71Å; C510-C521 WeakPolarHBondContact CB-SG 3.03Å; C510-C521 WeakPolarHBondContact SG-CB 3.43Å; C510-C521 CovalentContact SG-SG 2.04Å; C510-C521 PolarHBondContact SG-SG 2.99Å; Q515-C521 PolarHBondContact NE2-SG 2.91Å; C516-C521 HydrophobicContact CB-CB 4.4Å; C516-C521 VanDerWaalsContact SG-CB 3.52Å
522	R	87.4	Confident	83.9	Confident	121 Å²	121	69.2 Å²	69.2	46%	0.457	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	114.6	169.9	-175.8	167.6	70.3	-159.5	-0.3	110	E529 I531	R522-E529 HydrophobicContact CB-CG 4Å; R522-E529 IonicContact CZ-OE1 2.63Å; R522-E529 PolarHBondContact N-O 2.85Å; R522-E529 IonicContact NE-OE1 2.75Å; R522-E529 PolarHBondContact NE-OE1 2.66Å; R522-E529 IonicContact NH2-OE1 3.95Å; R522-E529 PolarHBondContact NH2-OE1 2.64Å; R522-E529 IonicContact NH2-OE2 2.85Å; R522-E529 PolarHBondContact NH2-OE2 2.03Å; R522-E529 PolarHBondContact O-N 2.95Å; R522-I531 HydrophobicContact CB-CD1 4.21Å
523	N	83	Confident	84.3	Confident	49 Å²	49	69.6 Å²	69.6	26%	0.262	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.9	149.5	175.3	-169.8	29.4	0	0	0	110.9	I507 D508 N509 C510 G527	I507-N523 PolarHBondContact O-ND2 3.25Å; I507-N523 PolarHBondContact O-OD1 3.21Å; D508-N523 WeakPolarHBondContact CA-ND2 3.24Å; N509-N523 WeakPolarHBondContact CB-OD1 3.38Å; N509-N523 PolarHBondContact N-OD1 2.03Å; N509-N523 VanDerWaalsContact N-OD1 3.09Å; N509-N523 PolarHBondContact ND2-OD1 2.85Å; C510-N523 PolarHBondContact SG-N 3.22Å; N523-G527 PolarHBondContact OD1-O 2.8Å
524	K	80.6	Confident	84.7	Confident	99 Å²	99	70.5 Å²	70.5	43%	0.43	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	159.7	-171.7	-112.3	176	166.9	170.5	0	110.8	G526 G527 E529	K524-G526 PolarHBondContact O-N 2.04Å; K524-G527 CarbonylContact C-O 3.55Å; K524-G527 VanDerWaalsContact CA-O 3.29Å; K524-G527 WeakPolarHBondContact CA-O 3.39Å; K524-G527 VanDerWaalsContact CB-O 3.24Å; K524-G527 WeakPolarHBondContact CB-O 3.42Å; K524-G527 PolarHBondContact N-O 3.25Å; K524-G527 PolarHBondContact O-N 3.13Å; K524-E529 HydrophobicContact CD-CB 4.4Å; K524-E529 HydrophobicContact CD-CG 4.26Å; K524-E529 WeakPolarHBondContact CD-OE1 3.29Å; K524-E529 VanDerWaalsContact CE-CD 3.47Å; K524-E529 WeakPolarHBondContact CE-OE1 3.49Å; K524-E529 IonicContact NZ-OE1 3.63Å; K524-E529 PolarHBondContact NZ-OE1 3.22Å; K524-E529 IonicContact NZ-OE2 3.95Å; K524-E529 PolarHBondContact NZ-OE2 3.29Å
525	K	77.9	Confident	84.6	Confident	101 Å²	101	66.4 Å²	66.4	44%	0.439	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.4	103.5	172.5	-175.7	175.4	178.4	175.8	0	109.7	E480 Y497 L506	E480-K525 IonicContact OE1-NZ 3.93Å; E480-K525 PolarHBondContact OE1-NZ 3.35Å; E480-K525 IonicContact OE2-NZ 2.67Å; Y497-K525 HydrophobicContact CD2-CG 3.86Å; Y497-K525 HydrophobicContact CE2-CD 4.17Å; Y497-K525 VanDerWaalsContact CE2-CE 3.42Å; Y497-K525 HydrophobicContact CE2-CG 3.83Å; Y497-K525 HydrophobicContact CG-CG 4.33Å; Y497-K525 WeakPolarHBondContact OH-CE 3.39Å; Y497-K525 PolarHBondContact OH-NZ 2.86Å; L506-K525 HydrophobicContact CD1-CB 4.29Å; L506-K525 HydrophobicContact CD2-CB 4.37Å; L506-K525 HydrophobicContact CD2-CG 4.3Å
526	G	76	Confident	84.6	Confident	57 Å²	57	68.6 Å²	68.6	59%	0.588	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.2	24.2	-179.5	0	0	0	0	0	116	K524	K524-G526 PolarHBondContact O-N 2.04Å
527	G	82.1	Confident	84.3	Confident	20 Å²	20	71.9 Å²	71.9	21%	0.206	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	159.1	-162	173.5	0	0	0	0	0	113.2	N509 N523 K524	N509-G527 PolarHBondContact ND2-N 2.83Å; N509-G527 PolarHBondContact ND2-O 3.27Å; N523-G527 PolarHBondContact OD1-O 2.8Å; K524-G527 CarbonylContact C-O 3.55Å; K524-G527 VanDerWaalsContact CA-O 3.29Å; K524-G527 WeakPolarHBondContact CA-O 3.39Å; K524-G527 VanDerWaalsContact CB-O 3.24Å; K524-G527 WeakPolarHBondContact CB-O 3.42Å; K524-G527 PolarHBondContact N-O 3.25Å; K524-G527 PolarHBondContact O-N 3.13Å
528	Y	85.5	Confident	84.3	Confident	87 Å²	87	73.5 Å²	73.5	34%	0.341	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	169.1	174.9	65.5	-93.5	0	0	0	112.1	N509 Q515 N540	N509-Y528 HydrophobicContact CB-CD1 4.18Å; N509-Y528 WeakPolarHBondContact O-CD1 3.44Å; Q515-Y528 HydrophobicContact CG-CE2 4.17Å; Q515-Y528 VanDerWaalsContact NE2-CD1 3.34Å; Q515-Y528 VanDerWaalsContact NE2-CG 3.28Å; Y528-N540 PolarHBondContact OH-ND2 3.01Å
529	E	88.4	Confident	84.3	Confident	47 Å²	47	77.4 Å²	77.4	22%	0.22	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	146	159.5	71	-163.9	135.5	0	0	110.3	R522 K524	R522-E529 HydrophobicContact CB-CG 4Å; R522-E529 IonicContact CZ-OE1 2.63Å; R522-E529 PolarHBondContact N-O 2.85Å; R522-E529 IonicContact NE-OE1 2.75Å; R522-E529 PolarHBondContact NE-OE1 2.66Å; R522-E529 IonicContact NH2-OE1 3.95Å; R522-E529 PolarHBondContact NH2-OE1 2.64Å; R522-E529 IonicContact NH2-OE2 2.85Å; R522-E529 PolarHBondContact NH2-OE2 2.03Å; R522-E529 PolarHBondContact O-N 2.95Å; K524-E529 HydrophobicContact CD-CB 4.4Å; K524-E529 HydrophobicContact CD-CG 4.26Å; K524-E529 WeakPolarHBondContact CD-OE1 3.29Å; K524-E529 VanDerWaalsContact CE-CD 3.47Å; K524-E529 WeakPolarHBondContact CE-OE1 3.49Å; K524-E529 IonicContact NZ-OE1 3.63Å; K524-E529 PolarHBondContact NZ-OE1 3.22Å; K524-E529 IonicContact NZ-OE2 3.95Å; K524-E529 PolarHBondContact NZ-OE2 3.29Å
530	C	89.7	Confident	84.3	Confident	21 Å²	21	78.4 Å²	78.4	14%	0.142	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	134	173	-55.3	0	0	0	0	110.1	C516 K539 C541	C516-C530 WeakPolarHBondContact CA-SG 3.45Å; C516-C530 HydrophobicContact CB-CB 3.59Å; C516-C530 WeakPolarHBondContact CB-SG 3.27Å; C516-C530 VanDerWaalsContact SG-CA 3.51Å; C516-C530 WeakPolarHBondContact SG-CB 3.48Å; C516-C530 CovalentContact SG-SG 2.03Å; C516-C530 PolarHBondContact SG-SG 3.27Å; C530-K539 WeakPolarHBondContact CB-O 3.26Å; C530-K539 PolarHBondContact SG-O 2.89Å; C530-K539 VanDerWaalsContact SG-O 3.35Å; C530-C541 VanDerWaalsContact CB-SG 3.51Å
531	I	88.2	Confident	84.3	Confident	76 Å²	76	70.5 Å²	70.5	39%	0.39	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	102.1	173.1	-57.2	176.2	0	0	0	106.2	G519 Y520 R522	G519-I531 CarbonylContact C-O 3.34Å; G519-I531 WeakPolarHBondContact CA-O 3.43Å; Y520-I531 PolarHBondContact N-O 3.31Å; Y520-I531 PolarHBondContact O-N 2.97Å; R522-I531 HydrophobicContact CB-CD1 4.21Å
532	C	87.3	Confident	84.2	Confident	43 Å²	43	76.7 Å²	76.7	29%	0.291	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	144.5	-172	-52.8	0	0	0	0	113	C541	C532-C541 WeakPolarHBondContact CA-SG 3.3Å; C532-C541 HydrophobicContact CB-CB 3.6Å; C532-C541 WeakPolarHBondContact CB-SG 3.01Å; C532-C541 PolarHBondContact N-SG 2.99Å; C532-C541 VanDerWaalsContact N-SG 3.41Å; C532-C541 VanDerWaalsContact SG-CA 3.54Å; C532-C541 WeakPolarHBondContact SG-CB 3.47Å; C532-C541 CovalentContact SG-SG 2.03Å; C532-C541 PolarHBondContact SG-SG 3.35Å
533	D	87.2	Confident	84	Confident	86 Å²	86	74.2 Å²	74.2	46%	0.46	38%	0.382	S	S	.	.	P	Polyproline II helix	trans	-69.7	158.5	171.2	-62.8	-41.4	0	0	0	110.8	Q518 G519 G535 Y536	Q518-D533 PolarHBondContact O-N 3.47Å; G519-D533 PolarHBondContact N-OD2 2.84Å; D533-G535 PolarHBondContact O-N 2.9Å; D533-Y536 HydrophobicContact CB-CD2 4.43Å; D533-Y536 PolarHBondContact O-N 2.88Å
534	E	81.9	Confident	83.6	Confident	203 Å²	203	76.9 Å²	76.9	95%	0.949	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	123.7	179.1	-68	-168.2	161	0	0	110.9
535	G	76.2	Confident	83.4	Confident	25 Å²	25	76 Å²	76	26%	0.258	39%	0.39	S	S	.	.	T	Hydrogen-bonded Turn	trans	99	1.3	-175	0	0	0	0	0	115.4	D533 K544 I545	D533-G535 PolarHBondContact O-N 2.9Å; G535-K544 CarbonylContact O-C 3.19Å; G535-K544 WeakPolarHBondContact O-CA 3.44Å; G535-K544 WeakPolarHBondContact O-CG 3.03Å; G535-I545 PolarHBondContact O-N 2.88Å
536	Y	85.9	Confident	83.1	Confident	67 Å²	67	75.6 Å²	75.6	26%	0.263	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	156	175.1	-67.3	-86.1	0	0	0	113.8	Q518 D533 T543 K544	Q518-Y536 HydrophobicContact CB-CD1 3.92Å; Q518-Y536 HydrophobicContact CB-CD2 3.49Å; Q518-Y536 VanDerWaalsContact CB-CD2 3.49Å; Q518-Y536 HydrophobicContact CB-CE1 3.97Å; Q518-Y536 HydrophobicContact CB-CE2 3.53Å; Q518-Y536 HydrophobicContact CB-CG 3.69Å; Q518-Y536 HydrophobicContact CG-CD1 4.29Å; Q518-Y536 HydrophobicContact CG-CD2 4.27Å; Q518-Y536 HydrophobicContact CG-CE1 3.85Å; Q518-Y536 HydrophobicContact CG-CE2 3.82Å; Q518-Y536 HydrophobicContact CG-CG 4.48Å; D533-Y536 HydrophobicContact CB-CD2 4.43Å; D533-Y536 PolarHBondContact O-N 2.88Å; Y536-T543 CarbonylContact C-O 3.57Å; Y536-T543 WeakPolarHBondContact CA-O 3.27Å; Y536-K544 HydrophobicContact CD1-CB 4.34Å; Y536-K544 HydrophobicContact CE1-CB 4.07Å; Y536-K544 HydrophobicContact CE1-CG 4.28Å
537	T	81.2	Confident	82.8	Confident	73 Å²	73	75.8 Å²	75.8	45%	0.448	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	-170.9	-178.2	-168.8	0	0	0	0	111.1	C541 R542 T543 I545	T537-C541 VanDerWaalsContact O-CA 3.23Å; T537-C541 WeakPolarHBondContact O-CA 3.33Å; T537-R542 PolarHBondContact O-N 3.12Å; T537-T543 VanDerWaalsContact C-OG1 3.32Å; T537-T543 WeakPolarHBondContact CG2-OG1 3.1Å; T537-T543 PolarHBondContact N-O 2.87Å; T537-T543 PolarHBondContact O-OG1 3.11Å; T537-T543 VanDerWaalsContact O-OG1 3.11Å; T537-I545 HydrophobicContact CG2-CG1 4.06Å
538	D	84.2	Confident	82.6	Confident	66 Å²	66	75.9 Å²	75.9	35%	0.353	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	67.4	175.9	-162.8	85.4	66.1	0	0	0	115.2	N540 C541 R542 T543	D538-N540 PolarHBondContact O-N 2.82Å; D538-N540 WeakPolarHBondContact OD1-CA 3.39Å; D538-N540 PolarHBondContact OD1-N 3.45Å; D538-C541 PolarHBondContact OD1-N 2.86Å; D538-R542 PolarHBondContact OD2-N 3.05Å; D538-T543 WeakPolarHBondContact CB-OG1 3.32Å; D538-T543 WeakPolarHBondContact OD2-CB 3.03Å; D538-T543 WeakPolarHBondContact OD2-CG2 3Å; D538-T543 PolarHBondContact OD2-N 3.03Å; D538-T543 PolarHBondContact OD2-OG1 2.96Å
539	K	84.7	Confident	82.1	Confident	179 Å²	179	75.5 Å²	75.5	78%	0.778	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.5	-20.7	-173.8	-68.9	-172.5	176.4	-173.7	0	114.2	C530	C530-K539 WeakPolarHBondContact CB-O 3.26Å; C530-K539 PolarHBondContact SG-O 2.89Å; C530-K539 VanDerWaalsContact SG-O 3.35Å
540	N	86.6	Confident	81.4	Confident	40 Å²	40	81.2 Å²	81.2	21%	0.214	42%	0.423	C	S	.	.	T	Hydrogen-bonded Turn	trans	-123	7.9	-171.1	-71.8	64.9	0	0	0	111.2	Q515 C516 G517 Y528 D538 R542	Q515-N540 WeakPolarHBondContact O-CB 3.47Å; Q515-N540 PolarHBondContact O-ND2 3.15Å; C516-N540 CarbonylContact C-O 3.59Å; C516-N540 WeakPolarHBondContact CA-O 3.44Å; C516-N540 VanDerWaalsContact O-O 3.09Å; G517-N540 PolarHBondContact N-O 3.09Å; Y528-N540 PolarHBondContact OH-ND2 3.01Å; D538-N540 PolarHBondContact O-N 2.82Å; D538-N540 WeakPolarHBondContact OD1-CA 3.39Å; D538-N540 PolarHBondContact OD1-N 3.45Å; N540-R542 VanDerWaalsContact C-N 3.33Å; N540-R542 HydrophobicContact CB-CG 4.09Å; N540-R542 VanDerWaalsContact O-CG 3.29Å; N540-R542 WeakPolarHBondContact O-CG 3.06Å; N540-R542 PolarHBondContact O-N 3.15Å
541	C	87.7	Confident	80.7	Confident	0 Å²	0	81.8 Å²	81.8	0%	0	42%	0.424	C	S	.	.	T	Hydrogen-bonded Turn	trans	53.5	44.8	176.5	-42.7	0	0	0	0	113.3	C516 Q518 C530 C532 T537 D538	C516-C541 WeakPolarHBondContact O-CB 3.24Å; Q518-C541 PolarHBondContact N-O 2.03Å; Q518-C541 VanDerWaalsContact O-CB 3.27Å; Q518-C541 WeakPolarHBondContact O-CB 3Å; C530-C541 VanDerWaalsContact CB-SG 3.51Å; C532-C541 WeakPolarHBondContact CA-SG 3.3Å; C532-C541 HydrophobicContact CB-CB 3.6Å; C532-C541 WeakPolarHBondContact CB-SG 3.01Å; C532-C541 PolarHBondContact N-SG 2.99Å; C532-C541 VanDerWaalsContact N-SG 3.41Å; C532-C541 VanDerWaalsContact SG-CA 3.54Å; C532-C541 WeakPolarHBondContact SG-CB 3.47Å; C532-C541 CovalentContact SG-SG 2.03Å; C532-C541 PolarHBondContact SG-SG 3.35Å; T537-C541 VanDerWaalsContact O-CA 3.23Å; T537-C541 WeakPolarHBondContact O-CA 3.33Å; D538-C541 PolarHBondContact OD1-N 2.86Å
542	R	86.2	Confident	80.4	Confident	150 Å²	150	84.2 Å²	84.2	57%	0.566	43%	0.434	S	S	*	.			trans	-106.8	-24.8	-177.1	-59.8	-168.9	173.2	-176.9	-7.3	112.9	N514 T537 D538 N540	N514-R542 PolarHBondContact O-NH2 2.75Å; T537-R542 PolarHBondContact O-N 3.12Å; D538-R542 PolarHBondContact OD2-N 3.05Å; N540-R542 VanDerWaalsContact C-N 3.33Å; N540-R542 HydrophobicContact CB-CG 4.09Å; N540-R542 VanDerWaalsContact O-CG 3.29Å; N540-R542 WeakPolarHBondContact O-CG 3.06Å; N540-R542 PolarHBondContact O-N 3.15Å
543	T	82.8	Confident	80.2	Confident	69 Å²	69	83.2 Å²	83.2	42%	0.423	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	122	173.3	45.8	0	0	0	0	110.3	Y536 T537 D538	Y536-T543 CarbonylContact C-O 3.57Å; Y536-T543 WeakPolarHBondContact CA-O 3.27Å; T537-T543 VanDerWaalsContact C-OG1 3.32Å; T537-T543 WeakPolarHBondContact CG2-OG1 3.1Å; T537-T543 PolarHBondContact N-O 2.87Å; T537-T543 PolarHBondContact O-OG1 3.11Å; T537-T543 VanDerWaalsContact O-OG1 3.11Å; D538-T543 WeakPolarHBondContact CB-OG1 3.32Å; D538-T543 WeakPolarHBondContact OD2-CB 3.03Å; D538-T543 WeakPolarHBondContact OD2-CG2 3Å; D538-T543 PolarHBondContact OD2-N 3.03Å; D538-T543 PolarHBondContact OD2-OG1 2.96Å
544	K	76.3	Confident	80	Confident	106 Å²	106	85.8 Å²	85.8	46%	0.461	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	138.1	168.8	-163.5	178.8	-172.4	-179.9	0	108.6	G535 Y536 D546 D563	G535-K544 CarbonylContact O-C 3.19Å; G535-K544 WeakPolarHBondContact O-CA 3.44Å; G535-K544 WeakPolarHBondContact O-CG 3.03Å; Y536-K544 HydrophobicContact CD1-CB 4.34Å; Y536-K544 HydrophobicContact CE1-CB 4.07Å; Y536-K544 HydrophobicContact CE1-CG 4.28Å; K544-D546 PolarHBondContact O-N 3.48Å; K544-D563 IonicContact NZ-OD1 3.75Å; K544-D563 PolarHBondContact NZ-OD1 2.88Å
545	I	74.8	Confident	79.9	Confident	80 Å²	80	80.1 Å²	80.1	41%	0.41	41%	0.406	S	S	.	.	P	Polyproline II helix	trans	-63.5	117.7	175.8	-65.3	173.9	0	0	0	108.2	G535 T537 Q547	G535-I545 PolarHBondContact O-N 2.88Å; T537-I545 HydrophobicContact CG2-CG1 4.06Å; I545-Q547 PolarHBondContact O-N 3.15Å
546	D	71.6	Confident	80.1	Confident	92 Å²	92	82.1 Å²	82.1	49%	0.492	43%	0.427	S	S	.	.			trans	-72.5	98.7	171.1	-178.9	11.8	0	0	0	109.5	K544 C548 A549	K544-D546 PolarHBondContact O-N 3.48Å; D546-C548 PolarHBondContact O-N 3.36Å; D546-C548 VanDerWaalsContact O-N 3.13Å; D546-C548 WeakPolarHBondContact OD1-CB 3.23Å; D546-C548 PolarHBondContact OD1-N 2.83Å; D546-A549 HydrophobicContact CB-CB 4.3Å; D546-A549 VanDerWaalsContact O-CB 3.28Å; D546-A549 WeakPolarHBondContact O-CB 3.21Å; D546-A549 PolarHBondContact O-N 3.09Å
547	Q	70.3	Confident	80	Confident	61 Å²	61	79.6 Å²	79.6	29%	0.285	42%	0.421	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-15.2	178.8	-59.2	-179.2	7.6	0	0	113.1	I545 I551 Y566	I545-Q547 PolarHBondContact O-N 3.15Å; Q547-I551 WeakPolarHBondContact O-CD1 3.38Å; Q547-I551 WeakPolarHBondContact O-CG1 3.42Å; Q547-Y566 HydrophobicContact CB-CD1 4.48Å
548	C	77.6	Confident	80.3	Confident	23 Å²	23	79.6 Å²	79.6	16%	0.155	43%	0.425	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.9	-7.3	175.1	-72.4	0	0	0	0	113.8	D546 D550 I551 C559	D546-C548 PolarHBondContact O-N 3.36Å; D546-C548 VanDerWaalsContact O-N 3.13Å; D546-C548 WeakPolarHBondContact OD1-CB 3.23Å; D546-C548 PolarHBondContact OD1-N 2.83Å; C548-D550 VanDerWaalsContact C-N 3.33Å; C548-D550 PolarHBondContact O-N 3.08Å; C548-I551 PolarHBondContact O-N 3.14Å; C548-C559 VanDerWaalsContact CA-SG 3.59Å; C548-C559 HydrophobicContact CB-CB 3.78Å; C548-C559 WeakPolarHBondContact CB-SG 3.46Å; C548-C559 WeakPolarHBondContact SG-CB 3.3Å; C548-C559 CovalentContact SG-SG 2.04Å; C548-C559 PolarHBondContact SG-SG 3.33Å
549	A	75	Confident	80.4	Confident	78 Å²	78	78 Å²	78	65%	0.645	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	-34.7	-171	0	0	0	0	0	114.6	D546	D546-A549 HydrophobicContact CB-CB 4.3Å; D546-A549 VanDerWaalsContact O-CB 3.28Å; D546-A549 WeakPolarHBondContact O-CB 3.21Å; D546-A549 PolarHBondContact O-N 3.09Å
550	D	73.2	Confident	80.3	Confident	168 Å²	168	72.2 Å²	72.2	90%	0.898	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.5	11.8	176.9	-84.3	-40.6	0	0	0	113.2	C548	C548-D550 VanDerWaalsContact C-N 3.33Å; C548-D550 PolarHBondContact O-N 3.08Å
551	I	75.3	Confident	79.5	Confident	32 Å²	32	73.2 Å²	73.2	16%	0.164	41%	0.408	C	S	.	.			trans	-110.7	98.9	-166.3	-56.3	-164.5	0	0	0	113.4	Q547 C548 C553 Y566 Y578	Q547-I551 WeakPolarHBondContact O-CD1 3.38Å; Q547-I551 WeakPolarHBondContact O-CG1 3.42Å; C548-I551 PolarHBondContact O-N 3.14Å; I551-C553 PolarHBondContact O-N 3.36Å; I551-Y566 HydrophobicContact CD1-CD1 3.37Å; I551-Y566 HydrophobicContact CD1-CD2 3.37Å; I551-Y566 HydrophobicContact CD1-CE1 3.52Å; I551-Y566 HydrophobicContact CD1-CE2 3.52Å; I551-Y566 HydrophobicContact CD1-CG 3.28Å; I551-Y566 HydrophobicContact CG2-CD2 4.41Å; I551-Y578 HydrophobicContact CG2-CD1 4.07Å; I551-Y578 HydrophobicContact CG2-CE1 4.04Å
552	E	81.3	Confident	78.5	Confident	128 Å²	128	77.3 Å²	77.3	60%	0.598	43%	0.43	S	S	*	.			trans	-80.5	88.2	172.4	-171.3	-169	-128.3	0	0	111.7	R554	E552-R554 PolarHBondContact O-N 3.3Å; E552-R554 IonicContact OE2-CZ 2.67Å; E552-R554 VanDerWaalsContact OE2-CZ 3.3Å; E552-R554 IonicContact OE2-NE 2.6Å; E552-R554 PolarHBondContact OE2-NE 2.98Å; E552-R554 IonicContact OE2-NH2 2.94Å; E552-R554 PolarHBondContact OE2-NH2 3.34Å
553	C	83.4	Confident	77.4	Confident	22 Å²	22	76.9 Å²	76.9	15%	0.149	44%	0.439	C	S	.	.			trans	-66	122.8	166.2	-58.4	0	0	0	0	110.5	I551 G557 C559 C568	I551-C553 PolarHBondContact O-N 3.36Å; C553-G557 WeakPolarHBondContact CB-O 3.33Å; C553-C559 VanDerWaalsContact SG-CB 3.54Å; C553-C559 PolarHBondContact SG-N 3.02Å; C553-C568 VanDerWaalsContact CA-SG 3.56Å; C553-C568 HydrophobicContact CB-CB 3.79Å; C553-C568 WeakPolarHBondContact CB-SG 3.32Å; C553-C568 VanDerWaalsContact SG-CA 3.53Å; C553-C568 WeakPolarHBondContact SG-CB 3.29Å; C553-C568 CovalentContact SG-SG 2.04Å; C553-C568 PolarHBondContact SG-SG 2.66Å
554	R	82.8	Confident	76.5	Confident	139 Å²	139	83 Å²	83	53%	0.525	46%	0.463	S	S	.	.			trans	-89	171.3	-173.1	-63.7	-169.1	163.6	-171.9	-5.9	112.6	E552 G556 G557 Y578 C579	E552-R554 PolarHBondContact O-N 3.3Å; E552-R554 IonicContact OE2-CZ 2.67Å; E552-R554 VanDerWaalsContact OE2-CZ 3.3Å; E552-R554 IonicContact OE2-NE 2.6Å; E552-R554 PolarHBondContact OE2-NE 2.98Å; E552-R554 IonicContact OE2-NH2 2.94Å; E552-R554 PolarHBondContact OE2-NH2 3.34Å; R554-G556 PolarHBondContact O-N 2.66Å; R554-G557 PolarHBondContact O-N 2.96Å; R554-Y578 WeakPolarHBondContact CB-O 3.17Å; R554-Y578 PolarHBondContact N-O 3.47Å; R554-C579 WeakPolarHBondContact O-CB 3.44Å
555	N	80.6	Confident	76.2	Confident	84 Å²	84	79 Å²	79	45%	0.449	45%	0.451	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.1	31.7	176.4	-57.8	-45.3	0	0	0	115	P571 T574 C579 E580	N555-P571 WeakPolarHBondContact O-CG 3.47Å; N555-T574 HydrophobicContact CB-CG2 3.77Å; N555-C579 PolarHBondContact ND2-O 2.97Å; N555-E580 PolarHBondContact ND2-O 3.38Å
556	G	80.9	Confident	76.3	Confident	67 Å²	67	78.3 Å²	78.3	69%	0.691	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.1	16.4	-179.1	0	0	0	0	0	115.3	R554	R554-G556 PolarHBondContact O-N 2.66Å
557	G	84.4	Confident	76.8	Confident	14 Å²	14	77.1 Å²	77.1	14%	0.144	44%	0.44	C	S	.	.			trans	-65.4	152.3	169.3	0	0	0	0	0	112.7	C553 R554 N569	C553-G557 WeakPolarHBondContact CB-O 3.33Å; R554-G557 PolarHBondContact O-N 2.96Å; G557-N569 VanDerWaalsContact CA-O 3.27Å; G557-N569 WeakPolarHBondContact CA-O 3.45Å
558	S	86.9	Confident	77.5	Confident	74 Å²	74	74.7 Å²	74.7	52%	0.517	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	119.1	-179.4	-179.7	0	0	0	0	111	N569	S558-N569 PolarHBondContact N-O 3.4Å; S558-N569 WeakPolarHBondContact O-CB 3.1Å; S558-N569 PolarHBondContact O-N 3.15Å; S558-N569 PolarHBondContact O-ND2 2.92Å
559	C	86	Confident	77.8	Confident	32 Å²	32	77.5 Å²	77.5	22%	0.216	44%	0.443	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70	130.4	177.5	-166.4	0	0	0	0	110.6	C548 C553	C548-C559 VanDerWaalsContact CA-SG 3.59Å; C548-C559 HydrophobicContact CB-CB 3.78Å; C548-C559 WeakPolarHBondContact CB-SG 3.46Å; C548-C559 WeakPolarHBondContact SG-CB 3.3Å; C548-C559 CovalentContact SG-SG 2.04Å; C548-C559 PolarHBondContact SG-SG 3.33Å; C553-C559 VanDerWaalsContact SG-CB 3.54Å; C553-C559 PolarHBondContact SG-N 3.02Å
560	T	81.5	Confident	78.3	Confident	58 Å²	58	76 Å²	76	36%	0.356	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	128	164.3	50.7	0	0	0	0	109	Y566 T567 N569	T560-Y566 CarbonylContact O-C 3.53Å; T560-Y566 WeakPolarHBondContact O-CA 3.08Å; T560-T567 PolarHBondContact N-O 2.8Å; T560-T567 PolarHBondContact O-N 3.08Å; T560-T567 PolarHBondContact OG1-O 2.82Å; T560-N569 VanDerWaalsContact CG2-ND2 3.33Å; T560-N569 WeakPolarHBondContact CG2-ND2 3.21Å; T560-N569 PolarHBondContact OG1-ND2 3.46Å
561	S	71.1	Confident	78.8	Confident	60 Å²	60	70.6 Å²	70.6	42%	0.42	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	127.8	172.8	42	0	0	0	0	110.3
562	N	67.3	Low	79.2	Confident	86 Å²	86	79.6 Å²	79.6	46%	0.46	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	174.9	179.5	-54.7	-5.1	0	0	0	108.9	E564 G565	N562-E564 VanDerWaalsContact C-N 3.26Å; N562-E564 PolarHBondContact O-N 3.31Å; N562-G565 WeakPolarHBondContact CA-O 3.41Å; N562-G565 WeakPolarHBondContact CB-O 3.48Å; N562-G565 PolarHBondContact N-O 2.03Å; N562-G565 PolarHBondContact O-N 2.81Å
563	D	62.7	Low	78.9	Confident	141 Å²	141	75 Å²	75	75%	0.754	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.9	-23.9	176.1	-63.7	-56	0	0	0	113.8	K544	K544-D563 IonicContact NZ-OD1 3.75Å; K544-D563 PolarHBondContact NZ-OD1 2.88Å
564	E	63.3	Low	78.8	Confident	198 Å²	198	74.9 Å²	74.9	93%	0.925	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97	-5.2	-179.9	-61.1	-175	148.3	0	0	114.2	N562	N562-E564 VanDerWaalsContact C-N 3.26Å; N562-E564 PolarHBondContact O-N 3.31Å
565	G	69.7	Low	78.6	Confident	21 Å²	21	72 Å²	72	22%	0.216	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	149.1	-179.8	-173.4	0	0	0	0	0	114	N562	N562-G565 WeakPolarHBondContact CA-O 3.41Å; N562-G565 WeakPolarHBondContact CB-O 3.48Å; N562-G565 PolarHBondContact N-O 2.03Å; N562-G565 PolarHBondContact O-N 2.81Å
566	Y	77.3	Confident	78.6	Confident	67 Å²	67	69.5 Å²	69.5	26%	0.263	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	161.1	171.8	61	-92.6	0	0	0	112.2	Q547 I551 T560 F577 Y578	Q547-Y566 HydrophobicContact CB-CD1 4.48Å; I551-Y566 HydrophobicContact CD1-CD1 3.37Å; I551-Y566 HydrophobicContact CD1-CD2 3.37Å; I551-Y566 HydrophobicContact CD1-CE1 3.52Å; I551-Y566 HydrophobicContact CD1-CE2 3.52Å; I551-Y566 HydrophobicContact CD1-CG 3.28Å; I551-Y566 HydrophobicContact CG2-CD2 4.41Å; T560-Y566 CarbonylContact O-C 3.53Å; T560-Y566 WeakPolarHBondContact O-CA 3.08Å; Y566-F577 HydrophobicContact CE2-CD1 4.43Å; Y566-F577 AromaticContact CE2-CE1 3.5Å; Y566-F577 HydrophobicContact CE2-CE1 3.5Å; Y566-F577 VanDerWaalsContact CE2-CE1 3.5Å; Y566-F577 AromaticContact CE2-CZ 3.91Å; Y566-F577 HydrophobicContact CE2-CZ 3.91Å; Y566-F577 AromaticContact CZ-CE1 3.88Å; Y566-Y578 HydrophobicContact CE2-CE1 4.08Å; Y566-Y578 PolarHBondContact OH-OH 3.4Å
567	T	81.6	Confident	78.7	Confident	66 Å²	66	72.2 Å²	72.2	41%	0.405	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	131.1	171	-66.8	0	0	0	0	110.5	T560	T560-T567 PolarHBondContact N-O 2.8Å; T560-T567 PolarHBondContact O-N 3.08Å; T560-T567 PolarHBondContact OG1-O 2.82Å
568	C	84.5	Confident	78.6	Confident	10 Å²	10	76 Å²	76	7%	0.068	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	113.2	169.1	-71.5	0	0	0	0	110.2	C553 C570	C553-C568 VanDerWaalsContact CA-SG 3.56Å; C553-C568 HydrophobicContact CB-CB 3.79Å; C553-C568 WeakPolarHBondContact CB-SG 3.32Å; C553-C568 VanDerWaalsContact SG-CA 3.53Å; C553-C568 WeakPolarHBondContact SG-CB 3.29Å; C553-C568 CovalentContact SG-SG 2.04Å; C553-C568 PolarHBondContact SG-SG 2.66Å; C568-C570 PolarHBondContact O-N 3.16Å; C568-C570 PolarHBondContact O-SG 2.65Å
569	N	85.2	Confident	78.5	Confident	82 Å²	82	72.5 Å²	72.5	44%	0.439	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	106.6	175.5	-63.2	-82.2	0	0	0	109.9	G557 S558 T560	G557-N569 VanDerWaalsContact CA-O 3.27Å; G557-N569 WeakPolarHBondContact CA-O 3.45Å; S558-N569 PolarHBondContact N-O 3.4Å; S558-N569 WeakPolarHBondContact O-CB 3.1Å; S558-N569 PolarHBondContact O-N 3.15Å; S558-N569 PolarHBondContact O-ND2 2.92Å; T560-N569 VanDerWaalsContact CG2-ND2 3.33Å; T560-N569 WeakPolarHBondContact CG2-ND2 3.21Å; T560-N569 PolarHBondContact OG1-ND2 3.46Å
570	C	85.6	Confident	78.3	Confident	48 Å²	48	75.2 Å²	75.2	32%	0.324	40%	0.402	S	S	.	.	P	Polyproline II helix	trans	-84.8	132.9	-173.4	-54.9	0	0	0	0	113.1	C568 T574 C579	C568-C570 PolarHBondContact O-N 3.16Å; C568-C570 PolarHBondContact O-SG 2.65Å; C570-T574 WeakPolarHBondContact CB-OG1 3.5Å; C570-C579 WeakPolarHBondContact CA-SG 3.35Å; C570-C579 HydrophobicContact CB-CB 3.81Å; C570-C579 WeakPolarHBondContact CB-SG 3.49Å; C570-C579 WeakPolarHBondContact SG-CA 3.36Å; C570-C579 WeakPolarHBondContact SG-CB 3.24Å; C570-C579 CovalentContact SG-SG 2.04Å; C570-C579 PolarHBondContact SG-SG 2.88Å
571	P	83.8	Confident	78.2	Confident	54 Å²	54	75.6 Å²	75.6	35%	0.351	40%	0.402	S	S	.	.	P	Polyproline II helix	trans	-65.8	154.9	171.8	26.8	-34.6	0	0	0	112.1	N555 G573 T574	N555-P571 WeakPolarHBondContact O-CG 3.47Å; P571-G573 PolarHBondContact O-N 2.04Å; P571-T574 WeakPolarHBondContact CD-OG1 3.37Å; P571-T574 HydrophobicContact CG-CG2 4.29Å; P571-T574 PolarHBondContact O-N 3.48Å; P571-T574 PolarHBondContact O-OG1 3Å; P571-T574 VanDerWaalsContact O-OG1 3.06Å
572	K	82.4	Confident	78.2	Confident	221 Å²	221	75.3 Å²	75.3	96%	0.961	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.9	127.8	177.5	-70	-173.4	177.6	-177.4	0	111
573	G	75.7	Confident	78.1	Confident	32 Å²	32	74.3 Å²	74.3	33%	0.33	39%	0.392	S	S	.	.	T	Hydrogen-bonded Turn	trans	102.1	-3.8	-174	0	0	0	0	0	114.1	P571 T582 D583	P571-G573 PolarHBondContact O-N 2.04Å; G573-T582 WeakPolarHBondContact O-CA 3.26Å; G573-D583 WeakPolarHBondContact CA-OD2 3.43Å; G573-D583 PolarHBondContact O-N 3.09Å
574	T	82.3	Confident	78	Confident	19 Å²	19	73.6 Å²	73.6	12%	0.117	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	152	174.5	73	0	0	0	0	112.1	N555 C570 P571 I581 T582	N555-T574 HydrophobicContact CB-CG2 3.77Å; C570-T574 WeakPolarHBondContact CB-OG1 3.5Å; P571-T574 WeakPolarHBondContact CD-OG1 3.37Å; P571-T574 HydrophobicContact CG-CG2 4.29Å; P571-T574 PolarHBondContact O-N 3.48Å; P571-T574 PolarHBondContact O-OG1 3Å; P571-T574 VanDerWaalsContact O-OG1 3.06Å; T574-I581 CarbonylContact C-O 3.58Å; T574-I581 WeakPolarHBondContact CA-O 3.39Å; T574-I581 WeakPolarHBondContact CB-O 3.04Å; T574-T582 HydrophobicContact CG2-CG2 4.27Å
575	N	78.8	Confident	77.6	Confident	78 Å²	78	66.1 Å²	66.1	42%	0.417	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	171.4	-172	-85.3	-68.6	0	0	0	109.4	C579 E580 I581 D583	N575-C579 CarbonylContact O-C 3.42Å; N575-C579 WeakPolarHBondContact O-CA 3.01Å; N575-E580 PolarHBondContact O-N 2.04Å; N575-I581 HydrophobicContact CB-CB 4.17Å; N575-I581 PolarHBondContact N-O 2.57Å; N575-I581 WeakPolarHBondContact O-CA 3.31Å; N575-I581 VanDerWaalsContact O-CB 3.28Å; N575-I581 WeakPolarHBondContact O-CB 3.32Å; N575-I581 PolarHBondContact O-N 2.93Å; N575-D583 PolarHBondContact ND2-OD1 2.61Å
576	G	79.7	Confident	76.8	Confident	31 Å²	31	68.8 Å²	68.8	32%	0.32	37%	0.369	S	S	.	.	S	Bend	trans	98.3	165	-177.3	0	0	0	0	0	113.1	Y578 C579 E580	G576-Y578 VanDerWaalsContact C-N 3.34Å; G576-Y578 PolarHBondContact O-N 3.16Å; G576-C579 PolarHBondContact O-N 3.26Å; G576-C579 VanDerWaalsContact O-N 3.15Å; G576-E580 VanDerWaalsContact C-OE2 3.31Å; G576-E580 WeakPolarHBondContact CA-OE1 3.38Å
577	F	82.1	Confident	75.6	Confident	124 Å²	124	70.6 Å²	70.6	54%	0.544	38%	0.382	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.6	-27.3	-168	-168.8	-106.5	0	0	0	113.1	Y566 E580	Y566-F577 HydrophobicContact CE2-CD1 4.43Å; Y566-F577 AromaticContact CE2-CE1 3.5Å; Y566-F577 HydrophobicContact CE2-CE1 3.5Å; Y566-F577 VanDerWaalsContact CE2-CE1 3.5Å; Y566-F577 AromaticContact CE2-CZ 3.91Å; Y566-F577 HydrophobicContact CE2-CZ 3.91Å; Y566-F577 AromaticContact CZ-CE1 3.88Å; F577-E580 PolarHBondContact N-OE1 2.83Å; F577-E580 PolarHBondContact N-OE2 2.74Å; F577-E580 VanDerWaalsContact N-OE2 3.1Å
578	Y	82.8	Confident	74.3	Confident	94 Å²	94	71.2 Å²	71.2	37%	0.369	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.8	24.1	169.9	-55	-80.7	0	0	0	111.1	I551 R554 Y566 G576 E580	I551-Y578 HydrophobicContact CG2-CD1 4.07Å; I551-Y578 HydrophobicContact CG2-CE1 4.04Å; R554-Y578 WeakPolarHBondContact CB-O 3.17Å; R554-Y578 PolarHBondContact N-O 3.47Å; Y566-Y578 HydrophobicContact CE2-CE1 4.08Å; Y566-Y578 PolarHBondContact OH-OH 3.4Å; G576-Y578 VanDerWaalsContact C-N 3.34Å; G576-Y578 PolarHBondContact O-N 3.16Å; Y578-E580 VanDerWaalsContact C-OE2 3.32Å; Y578-E580 WeakPolarHBondContact CA-OE2 3.34Å; Y578-E580 PolarHBondContact N-OE2 2.96Å; Y578-E580 PolarHBondContact O-N 3.45Å
579	C	84.3	Confident	72.8	Confident	0 Å²	0	74.5 Å²	74.5	0%	0	40%	0.4	C	S	.	.	S	Bend	trans	56.7	27.1	-174.7	-47.4	0	0	0	0	114.4	R554 N555 C570 N575 G576 I581	R554-C579 WeakPolarHBondContact O-CB 3.44Å; N555-C579 PolarHBondContact ND2-O 2.97Å; C570-C579 WeakPolarHBondContact CA-SG 3.35Å; C570-C579 HydrophobicContact CB-CB 3.81Å; C570-C579 WeakPolarHBondContact CB-SG 3.49Å; C570-C579 WeakPolarHBondContact SG-CA 3.36Å; C570-C579 WeakPolarHBondContact SG-CB 3.24Å; C570-C579 CovalentContact SG-SG 2.04Å; C570-C579 PolarHBondContact SG-SG 2.88Å; N575-C579 CarbonylContact O-C 3.42Å; N575-C579 WeakPolarHBondContact O-CA 3.01Å; G576-C579 PolarHBondContact O-N 3.26Å; G576-C579 VanDerWaalsContact O-N 3.15Å; C579-I581 VanDerWaalsContact C-N 3.33Å; C579-I581 PolarHBondContact O-N 3.34Å
580	E	83.4	Confident	71.2	Confident	89 Å²	89	74.1 Å²	74.1	42%	0.416	40%	0.401	S	S	.	.			trans	-71.3	-20.9	-172.1	69.3	-74.2	171.8	0	0	114.7	N555 N575 G576 F577 Y578	N555-E580 PolarHBondContact ND2-O 3.38Å; N575-E580 PolarHBondContact O-N 2.04Å; G576-E580 VanDerWaalsContact C-OE2 3.31Å; G576-E580 WeakPolarHBondContact CA-OE1 3.38Å; F577-E580 PolarHBondContact N-OE1 2.83Å; F577-E580 PolarHBondContact N-OE2 2.74Å; F577-E580 VanDerWaalsContact N-OE2 3.1Å; Y578-E580 VanDerWaalsContact C-OE2 3.32Å; Y578-E580 WeakPolarHBondContact CA-OE2 3.34Å; Y578-E580 PolarHBondContact N-OE2 2.96Å; Y578-E580 PolarHBondContact O-N 3.45Å
581	I	78.5	Confident	69.9	Low	67 Å²	67	77.7 Å²	77.7	34%	0.344	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	137.3	-179.2	-46.3	177.3	0	0	0	109.2	T574 N575 C579 I586	T574-I581 CarbonylContact C-O 3.58Å; T574-I581 WeakPolarHBondContact CA-O 3.39Å; T574-I581 WeakPolarHBondContact CB-O 3.04Å; N575-I581 HydrophobicContact CB-CB 4.17Å; N575-I581 PolarHBondContact N-O 2.57Å; N575-I581 WeakPolarHBondContact O-CA 3.31Å; N575-I581 VanDerWaalsContact O-CB 3.28Å; N575-I581 WeakPolarHBondContact O-CB 3.32Å; N575-I581 PolarHBondContact O-N 2.93Å; C579-I581 VanDerWaalsContact C-N 3.33Å; C579-I581 PolarHBondContact O-N 3.34Å; I581-I586 HydrophobicContact CG2-CD1 4.45Å; I581-I586 HydrophobicContact CG2-CG1 4.14Å
582	T	70.5	Confident	68.7	Low	53 Å²	53	80.9 Å²	80.9	33%	0.325	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	147.4	166.1	57.1	0	0	0	0	109.5	G573 T574 N584 A585	G573-T582 WeakPolarHBondContact O-CA 3.26Å; T574-T582 HydrophobicContact CG2-CG2 4.27Å; T582-N584 PolarHBondContact O-N 2.75Å; T582-N584 VanDerWaalsContact O-N 3.13Å; T582-A585 VanDerWaalsContact O-CB 3.27Å; T582-A585 WeakPolarHBondContact O-CB 3.5Å; T582-A585 PolarHBondContact O-N 3.14Å
583	D	66.2	Low	67.7	Low	65 Å²	65	75.2 Å²	75.2	35%	0.348	39%	0.393	S	S	.	.	H	α-helix	trans	-62.3	-25.6	-175.7	-71.1	-10.2	0	0	0	113	G573 N575 A585 I586 I587	G573-D583 WeakPolarHBondContact CA-OD2 3.43Å; G573-D583 PolarHBondContact O-N 3.09Å; N575-D583 PolarHBondContact ND2-OD1 2.61Å; D583-A585 PolarHBondContact O-N 3.21Å; D583-I586 WeakPolarHBondContact O-CB 3.45Å; D583-I586 PolarHBondContact O-N 3.01Å; D583-I587 PolarHBondContact O-N 3.28Å
584	N	60.7	Low	67.2	Low	126 Å²	126	79.2 Å²	79.2	67%	0.674	41%	0.406	S	S	*	.	H	α-helix	trans	-57.7	-33.1	169.9	-73	-15.8	0	0	0	112.7	T582 I586 V588	T582-N584 PolarHBondContact O-N 2.75Å; T582-N584 VanDerWaalsContact O-N 3.13Å; N584-I586 VanDerWaalsContact C-N 3.33Å; N584-V588 WeakPolarHBondContact O-CG2 3.1Å
585	A	55.3	Low	66.4	Low	42 Å²	42	84.1 Å²	84.1	35%	0.347	43%	0.431	S	S	.	.	H	α-helix	trans	-72.2	-26.7	176.5	0	0	0	0	0	112.6	T582 D583 Q589	T582-A585 VanDerWaalsContact O-CB 3.27Å; T582-A585 WeakPolarHBondContact O-CB 3.5Å; T582-A585 PolarHBondContact O-N 3.14Å; D583-A585 PolarHBondContact O-N 3.21Å; A585-Q589 WeakPolarHBondContact O-CB 3.06Å; A585-Q589 WeakPolarHBondContact O-CG 3.47Å; A585-Q589 PolarHBondContact O-N 3.05Å
586	I	53	Low	65.9	Low	76 Å²	76	84.9 Å²	84.9	39%	0.39	43%	0.434	S	S	.	.	H	α-helix	trans	-71.7	-43.9	-179.5	-60.4	175.3	0	0	0	110.7	I581 D583 N584 V588 Q589 T590	I581-I586 HydrophobicContact CG2-CD1 4.45Å; I581-I586 HydrophobicContact CG2-CG1 4.14Å; D583-I586 WeakPolarHBondContact O-CB 3.45Å; D583-I586 PolarHBondContact O-N 3.01Å; N584-I586 VanDerWaalsContact C-N 3.33Å; I586-V588 VanDerWaalsContact C-N 3.32Å; I586-V588 PolarHBondContact O-N 2.59Å; I586-Q589 WeakPolarHBondContact O-CB 3.29Å; I586-Q589 PolarHBondContact O-N 2.93Å; I586-T590 PolarHBondContact O-N 3.32Å; I586-T590 VanDerWaalsContact O-N 3.1Å; I586-T590 PolarHBondContact O-OG1 2.75Å
587	I	51.9	Low	65.4	Low	105 Å²	105	90.7 Å²	90.7	54%	0.538	45%	0.451	S	S	.	.	H	α-helix	trans	-57.6	-48.2	176.5	-63.2	174.7	0	0	0	110	D583 T590 E591	D583-I587 PolarHBondContact O-N 3.28Å; I587-T590 PolarHBondContact O-N 3.05Å; I587-T590 PolarHBondContact O-OG1 2.88Å; I587-E591 PolarHBondContact O-N 2.91Å
588	V	54	Low	64.8	Low	79 Å²	79	87.1 Å²	87.1	48%	0.479	44%	0.444	S	S	.	.	H	α-helix	trans	-62.4	-46.7	177	-175.1	0	0	0	0	110.4	N584 I586 T590 E591 W592	N584-V588 WeakPolarHBondContact O-CG2 3.1Å; I586-V588 VanDerWaalsContact C-N 3.32Å; I586-V588 PolarHBondContact O-N 2.59Å; V588-T590 PolarHBondContact O-N 2.04Å; V588-E591 PolarHBondContact O-N 3.26Å; V588-W592 PolarHBondContact O-N 3.42Å; V588-W592 PolarHBondContact O-NE1 3.26Å; V588-W592 VanDerWaalsContact O-NE1 3.07Å
589	Q	51.8	Low	64.3	Low	79 Å²	79	85.6 Å²	85.6	37%	0.369	45%	0.448	S	S	.	.	H	α-helix	trans	-51.7	-37.1	176.6	-79.9	-107.3	-8.7	0	0	114	A585 I586 W592 K593	A585-Q589 WeakPolarHBondContact O-CB 3.06Å; A585-Q589 WeakPolarHBondContact O-CG 3.47Å; A585-Q589 PolarHBondContact O-N 3.05Å; I586-Q589 WeakPolarHBondContact O-CB 3.29Å; I586-Q589 PolarHBondContact O-N 2.93Å; Q589-W592 HydrophobicContact CB-CZ2 4.39Å; Q589-W592 HydrophobicContact CG-CH2 4.48Å; Q589-W592 HydrophobicContact CG-CZ2 3.81Å; Q589-K593 WeakPolarHBondContact O-CD 3.31Å; Q589-K593 VanDerWaalsContact O-CG 3.29Å; Q589-K593 WeakPolarHBondContact O-CG 3.38Å
590	T	53.3	Low	63.6	Low	74 Å²	74	90.9 Å²	90.9	45%	0.454	48%	0.475	S	S	.	.	H	α-helix	trans	-70.9	-39.5	177	28.5	0	0	0	0	113.3	I586 I587 V588 K593 I594	I586-T590 PolarHBondContact O-N 3.32Å; I586-T590 VanDerWaalsContact O-N 3.1Å; I586-T590 PolarHBondContact O-OG1 2.75Å; I587-T590 PolarHBondContact O-N 3.05Å; I587-T590 PolarHBondContact O-OG1 2.88Å; V588-T590 PolarHBondContact O-N 2.04Å; T590-K593 PolarHBondContact O-N 3.19Å; T590-I594 VanDerWaalsContact O-CG1 3.29Å; T590-I594 WeakPolarHBondContact O-CG1 3.24Å; T590-I594 PolarHBondContact O-N 2.92Å
591	E	57.1	Low	63.1	Low	124 Å²	124	93.3 Å²	93.3	58%	0.579	48%	0.484	S	S	*	.	H	α-helix	trans	-67.5	-46.4	-175.8	-67.9	-170.3	149.7	0	0	112.7	I587 V588 K593 I594 L595	I587-E591 PolarHBondContact O-N 2.91Å; V588-E591 PolarHBondContact O-N 3.26Å; E591-K593 VanDerWaalsContact C-N 3.33Å; E591-K593 PolarHBondContact O-N 3.04Å; E591-I594 PolarHBondContact O-N 3.3Å; E591-L595 WeakPolarHBondContact O-CB 3.07Å; E591-L595 WeakPolarHBondContact O-CG 3.34Å; E591-L595 PolarHBondContact O-N 2.7Å
592	W	58.2	Low	62.7	Low	121 Å²	121	95.8 Å²	95.8	46%	0.458	50%	0.498	S	S	.	.	H	α-helix	trans	-69.2	-28.9	176.8	41.5	-82.7	0	0	0	113.2	V588 Q589 L596	V588-W592 PolarHBondContact O-N 3.42Å; V588-W592 PolarHBondContact O-NE1 3.26Å; V588-W592 VanDerWaalsContact O-NE1 3.07Å; Q589-W592 HydrophobicContact CB-CZ2 4.39Å; Q589-W592 HydrophobicContact CG-CH2 4.48Å; Q589-W592 HydrophobicContact CG-CZ2 3.81Å; W592-L596 VanDerWaalsContact O-CB 3.28Å; W592-L596 WeakPolarHBondContact O-CB 3.41Å; W592-L596 WeakPolarHBondContact O-CG 3.45Å; W592-L596 PolarHBondContact O-N 2.87Å
593	K	63.2	Low	62.6	Low	101 Å²	101	95.7 Å²	95.7	44%	0.439	50%	0.502	S	S	.	.	H	α-helix	trans	-68.5	-41.5	172.5	-73.9	174.8	-173.3	167.9	0	112	Q589 T590 E591 L596 F597	Q589-K593 WeakPolarHBondContact O-CD 3.31Å; Q589-K593 VanDerWaalsContact O-CG 3.29Å; Q589-K593 WeakPolarHBondContact O-CG 3.38Å; T590-K593 PolarHBondContact O-N 3.19Å; E591-K593 VanDerWaalsContact C-N 3.33Å; E591-K593 PolarHBondContact O-N 3.04Å; K593-L596 PolarHBondContact O-N 3.23Å; K593-F597 WeakPolarHBondContact O-CD2 3.34Å; K593-F597 PolarHBondContact O-N 3.07Å
594	I	64.8	Low	62.8	Low	116 Å²	116	100 Å²	100	60%	0.595	51%	0.514	S	S	*	.	H	α-helix	trans	-64.5	-43	175.2	-68.7	165	0	0	0	110.8	T590 E591 F597 A598	T590-I594 VanDerWaalsContact O-CG1 3.29Å; T590-I594 WeakPolarHBondContact O-CG1 3.24Å; T590-I594 PolarHBondContact O-N 2.92Å; E591-I594 PolarHBondContact O-N 3.3Å; I594-F597 PolarHBondContact O-N 2.92Å; I594-A598 WeakPolarHBondContact O-CB 2.99Å; I594-A598 PolarHBondContact O-N 2.89Å
595	L	65.5	Low	63.2	Low	122 Å²	122	103.1 Å²	103.1	64%	0.639	52%	0.516	S	S	*	.	H	α-helix	trans	-66.7	-37.9	177	-72.3	166.3	0	0	0	113.1	E591 S599	E591-L595 WeakPolarHBondContact O-CB 3.07Å; E591-L595 WeakPolarHBondContact O-CG 3.34Å; E591-L595 PolarHBondContact O-N 2.7Å; L595-S599 WeakPolarHBondContact O-CB 3.23Å; L595-S599 PolarHBondContact O-N 2.75Å; L595-S599 PolarHBondContact O-OG 2.81Å
596	L	67.2	Low	63.8	Low	94 Å²	94	109.5 Å²	109.5	49%	0.492	54%	0.539	S	S	.	.	H	α-helix	trans	-64.6	-45.4	172.3	-86.2	163.8	0	0	0	111.9	W592 K593 S599 L600	W592-L596 VanDerWaalsContact O-CB 3.28Å; W592-L596 WeakPolarHBondContact O-CB 3.41Å; W592-L596 WeakPolarHBondContact O-CG 3.45Å; W592-L596 PolarHBondContact O-N 2.87Å; K593-L596 PolarHBondContact O-N 3.23Å; L596-S599 WeakPolarHBondContact CA-OG 3.11Å; L596-S599 PolarHBondContact O-N 2.75Å; L596-S599 PolarHBondContact O-OG 2.03Å; L596-S599 VanDerWaalsContact O-OG 3.11Å; L596-L600 VanDerWaalsContact O-CB 3.3Å; L596-L600 WeakPolarHBondContact O-CB 3.39Å; L596-L600 VanDerWaalsContact O-CG 3.32Å; L596-L600 WeakPolarHBondContact O-CG 3.18Å; L596-L600 PolarHBondContact O-N 2.87Å
597	F	69.4	Low	64.3	Low	154 Å²	154	112.8 Å²	112.8	68%	0.675	56%	0.556	S	S	*	*	H	α-helix	trans	-63.3	-42.9	175.3	-94.8	-84.1	0	0	0	111.9	K593 I594 L600 F601	K593-F597 WeakPolarHBondContact O-CD2 3.34Å; K593-F597 PolarHBondContact O-N 3.07Å; I594-F597 PolarHBondContact O-N 2.92Å; F597-L600 PolarHBondContact O-N 2.84Å; F597-F601 WeakPolarHBondContact O-CB 3.14Å; F597-F601 PolarHBondContact O-N 2.69Å
598	A	69.6	Low	64.3	Low	48 Å²	48	118.5 Å²	118.5	40%	0.397	57%	0.573	S	S	.	*	H	α-helix	trans	-63.5	-43.5	178.2	0	0	0	0	0	112.7	I594 F601 L602	I594-A598 WeakPolarHBondContact O-CB 2.99Å; I594-A598 PolarHBondContact O-N 2.89Å; A598-F601 PolarHBondContact O-N 2.9Å; A598-L602 WeakPolarHBondContact O-CG 3.5Å; A598-L602 PolarHBondContact O-N 3.25Å
599	S	71.9	Confident	64.8	Low	63 Å²	63	120.5 Å²	120.5	44%	0.441	58%	0.577	S	S	.	*	H	α-helix	trans	-69	-39.1	177.4	50.8	0	0	0	0	112.6	L595 L596 L602 A603	L595-S599 WeakPolarHBondContact O-CB 3.23Å; L595-S599 PolarHBondContact O-N 2.75Å; L595-S599 PolarHBondContact O-OG 2.81Å; L596-S599 WeakPolarHBondContact CA-OG 3.11Å; L596-S599 PolarHBondContact O-N 2.75Å; L596-S599 PolarHBondContact O-OG 2.03Å; L596-S599 VanDerWaalsContact O-OG 3.11Å; S599-L602 PolarHBondContact O-N 2.05Å; S599-A603 WeakPolarHBondContact O-CB 3.39Å; S599-A603 PolarHBondContact O-N 2.97Å
600	L	69.2	Low	65.5	Low	111 Å²	111	122.6 Å²	122.6	58%	0.581	59%	0.588	S	S	*	*	H	α-helix	trans	-62.9	-41.1	171.4	-77.4	166	0	0	0	112.2	L596 F597 A603 W604	L596-L600 VanDerWaalsContact O-CB 3.3Å; L596-L600 WeakPolarHBondContact O-CB 3.39Å; L596-L600 VanDerWaalsContact O-CG 3.32Å; L596-L600 WeakPolarHBondContact O-CG 3.18Å; L596-L600 PolarHBondContact O-N 2.87Å; F597-L600 PolarHBondContact O-N 2.84Å; L600-A603 PolarHBondContact O-N 3.15Å; L600-W604 WeakPolarHBondContact O-CB 3.36Å; L600-W604 PolarHBondContact O-N 2.72Å
601	F	72.9	Confident	66.2	Low	139 Å²	139	125.3 Å²	125.3	61%	0.61	60%	0.596	S	S	*	*	H	α-helix	trans	-66.6	-37.7	178.1	-136.9	-88.1	0	0	0	112.2	F597 A598 R605	F597-F601 WeakPolarHBondContact O-CB 3.14Å; F597-F601 PolarHBondContact O-N 2.69Å; A598-F601 PolarHBondContact O-N 2.9Å; F601-R605 WeakPolarHBondContact O-CB 3.46Å; F601-R605 PolarHBondContact O-N 2.96Å; F601-R605 VanDerWaalsContact O-N 3.1Å
602	L	70.3	Confident	66.7	Low	120 Å²	120	125.4 Å²	125.4	63%	0.628	60%	0.597	S	S	*	*	H	α-helix	trans	-69.4	-39.2	174.5	-73.5	169.5	0	0	0	112.4	A598 S599 R605 Q606	A598-L602 WeakPolarHBondContact O-CG 3.5Å; A598-L602 PolarHBondContact O-N 3.25Å; S599-L602 PolarHBondContact O-N 2.05Å; L602-R605 CarbonylContact O-C 3.54Å; L602-R605 PolarHBondContact O-N 2.88Å; L602-Q606 PolarHBondContact O-N 2.88Å
603	A	69	Low	67.2	Low	50 Å²	50	125.7 Å²	125.7	41%	0.413	61%	0.605	S	S	.	*	H	α-helix	trans	-66.3	-42.4	174.5	0	0	0	0	0	112.1	S599 L600 R605 Q606 L607	S599-A603 WeakPolarHBondContact O-CB 3.39Å; S599-A603 PolarHBondContact O-N 2.97Å; L600-A603 PolarHBondContact O-N 3.15Å; A603-R605 VanDerWaalsContact C-N 3.28Å; A603-R605 PolarHBondContact O-N 3.39Å; A603-Q606 PolarHBondContact O-N 3.35Å; A603-Q606 VanDerWaalsContact O-N 3.08Å; A603-L607 PolarHBondContact O-N 3.27Å
604	W	69.8	Low	67.5	Low	155 Å²	155	127.3 Å²	127.3	59%	0.587	62%	0.616	S	S	*	*	H	α-helix	trans	-61.8	-38.4	176.4	-160.7	66.8	0	0	0	111.5	L600 Q606 L607 Y608	L600-W604 WeakPolarHBondContact O-CB 3.36Å; L600-W604 PolarHBondContact O-N 2.72Å; W604-Q606 PolarHBondContact O-N 3.25Å; W604-L607 PolarHBondContact O-N 2.99Å; W604-L607 VanDerWaalsContact O-N 3.13Å; W604-Y608 HydrophobicContact CD2-CD2 4.32Å; W604-Y608 AromaticContact CE2-CD2 3.83Å; W604-Y608 AromaticContact CE2-CE2 3.84Å; W604-Y608 HydrophobicContact CZ2-CD2 4.1Å; W604-Y608 AromaticContact CZ2-CE2 3.93Å; W604-Y608 HydrophobicContact CZ2-CE2 3.93Å; W604-Y608 AromaticContact NE1-CD2 3.84Å; W604-Y608 AromaticContact NE1-CE2 3.65Å; W604-Y608 PolarHBondContact O-N 3.1Å
605	R	70.5	Confident	67.7	Low	192 Å²	192	128.1 Å²	128.1	73%	0.725	62%	0.618	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.7	15.1	174.3	-155	-167	170.9	-175.1	-2.7	114.7	F601 L602 A603	F601-R605 WeakPolarHBondContact O-CB 3.46Å; F601-R605 PolarHBondContact O-N 2.96Å; F601-R605 VanDerWaalsContact O-N 3.1Å; L602-R605 CarbonylContact O-C 3.54Å; L602-R605 PolarHBondContact O-N 2.88Å; A603-R605 VanDerWaalsContact C-N 3.28Å; A603-R605 PolarHBondContact O-N 3.39Å
606	Q	66.8	Low	67.9	Low	177 Å²	177	128.6 Å²	128.6	83%	0.827	62%	0.616	S	S	*	*	T	Hydrogen-bonded Turn	trans	-123.3	0.4	161.1	-69.8	-158.6	-14.6	0	0	112.8	L602 A603 W604	L602-Q606 PolarHBondContact O-N 2.88Å; A603-Q606 PolarHBondContact O-N 3.35Å; A603-Q606 VanDerWaalsContact O-N 3.08Å; W604-Q606 PolarHBondContact O-N 3.25Å
607	L	63.8	Low	67.9	Low	145 Å²	145	131.5 Å²	131.5	76%	0.759	63%	0.627	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.4	-3.5	172	-71	163.7	0	0	0	112.2	A603 W604	A603-L607 PolarHBondContact O-N 3.27Å; W604-L607 PolarHBondContact O-N 2.99Å; W604-L607 VanDerWaalsContact O-N 3.13Å
608	Y	52	Low	67.8	Low	224 Å²	224	129.5 Å²	129.5	88%	0.878	62%	0.622	S	S	*	*			trans	-136.6	0	170	-81.4	-83.8	0	0	0	109.3	W604	W604-Y608 HydrophobicContact CD2-CD2 4.32Å; W604-Y608 AromaticContact CE2-CD2 3.83Å; W604-Y608 AromaticContact CE2-CE2 3.84Å; W604-Y608 HydrophobicContact CZ2-CD2 4.1Å; W604-Y608 AromaticContact CZ2-CE2 3.93Å; W604-Y608 HydrophobicContact CZ2-CE2 3.93Å; W604-Y608 AromaticContact NE1-CD2 3.84Å; W604-Y608 AromaticContact NE1-CE2 3.65Å; W604-Y608 PolarHBondContact O-N 3.1Å

Retrieved 608 of 608 residues in 792 ms (Link to these results)

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