A0A077YZ49_TRITR Loading...

Soluble calcium activated nucleotidase 1

AlphaFold DB , UniProt , Accession A0A077YZ49, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 388 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	41.2	Very low	36.3	Very low	235 Å²	235	154 Å²	154	100%	1.158	82%	0.82	S	S	*	*				0	127.2	0	-84.7	173.8	165.6	0	0	107.7
2	N	38.7	Very low	36.2	Very low	147 Å²	147	153.8 Å²	153.8	79%	0.786	82%	0.819	S	S	*	*			trans	62.9	140.6	160.9	-66.5	4.3	0	0	0	118.1
3	T	36.2	Very low	36.1	Very low	112 Å²	112	155.8 Å²	155.8	69%	0.687	82%	0.817	S	S	*	*			cis	-170.6	137.5	-15.4	20	0	0	0	0	104.2
4	T	33.1	Very low	35.9	Very low	137 Å²	137	159.1 Å²	159.1	84%	0.84	82%	0.821	S	S	*	*			trans	-10	130	143.8	6.5	0	0	0	0	117.9
5	A	39.8	Very low	35.9	Very low	94 Å²	94	157 Å²	157	78%	0.777	83%	0.826	S	S	*	*			trans	179.7	106	134.2	0	0	0	0	0	106.6
6	D	36.4	Very low	35.9	Very low	156 Å²	156	151.4 Å²	151.4	83%	0.834	82%	0.818	S	S	*	*				89.9	138.3	62.3	-152.4	13.6	0	0	0	113.7
7	S	35.6	Very low	35.7	Very low	94 Å²	94	157.4 Å²	157.4	66%	0.657	83%	0.826	S	S	*	*			trans	79.3	112.2	166	74.3	0	0	0	0	122.2
8	E	35.8	Very low	35.5	Very low	168 Å²	168	155.3 Å²	155.3	79%	0.785	83%	0.827	S	S	*	*				87.2	97.9	124	-67.7	-171.7	161.8	0	0	122.6
9	R	31.7	Very low	35.6	Very low	223 Å²	223	154.6 Å²	154.6	84%	0.842	82%	0.822	S	S	*	*				60.4	92.5	107.7	-155.2	-169.6	-74.8	-161.1	1.7	117.2
10	K	35.6	Very low	35.7	Very low	192 Å²	192	153 Å²	153	84%	0.835	82%	0.818	S	S	*	*			trans	-161.7	112.1	130.3	-107.7	176.1	-174.6	-177.4	0	110.3
11	V	35.2	Very low	35.7	Very low	136 Å²	136	149.1 Å²	149.1	82%	0.824	81%	0.814	S	S	*	*			trans	-93.8	96	173.4	175.5	0	0	0	0	106.7
12	D	35.7	Very low	35.6	Very low	151 Å²	151	144.5 Å²	144.5	81%	0.807	80%	0.799	S	S	*	*			trans	-87.4	115.3	167.6	-86.6	-35.8	0	0	0	109.6
13	K	34.4	Very low	35.9	Very low	181 Å²	181	141.9 Å²	141.9	79%	0.787	79%	0.793	S	S	*	*			trans	-73.1	135.7	174	-90.9	177.3	175.6	172.6	0	110
14	K	33	Very low	36.2	Very low	201 Å²	201	139.8 Å²	139.8	87%	0.874	79%	0.793	S	S	*	*			trans	74.8	97.5	153.5	-63.7	178.9	176	-173.4	0	117.4
15	S	36.2	Very low	37	Very low	128 Å²	128	140.7 Å²	140.7	90%	0.895	78%	0.781	S	S	*	*			trans	-110.9	83.8	146.7	51.5	0	0	0	0	108.9
16	G	35.7	Very low	37.8	Very low	68 Å²	68	140.7 Å²	140.7	70%	0.701	77%	0.772	S	S	*	*			trans	-79.3	135.6	165.6	0	0	0	0	0	109.4	S18	G16-S18 PolarHBondContact O-N 3.27Å
17	W	32.3	Very low	39.2	Very low	252 Å²	252	141 Å²	141	96%	0.955	77%	0.768	S	S	*	*			trans	-51.8	120.4	174.7	-79.7	-27.4	0	0	0	112.3
18	S	33.2	Very low	40.8	Very low	120 Å²	120	140.5 Å²	140.5	84%	0.839	76%	0.763	S	S	*	*			trans	-93.7	100.4	164.3	55.5	0	0	0	0	109	G16	G16-S18 PolarHBondContact O-N 3.27Å
19	I	37.3	Very low	42.4	Very low	142 Å²	142	135.2 Å²	135.2	73%	0.728	74%	0.742	S	S	*	*			trans	-90.6	120	165.4	-69.6	178.6	0	0	0	107.3
20	V	37.5	Very low	44.1	Very low	122 Å²	122	130.5 Å²	130.5	74%	0.739	73%	0.728	S	S	*	*			trans	55.3	98.7	151.5	-173.9	0	0	0	0	116	T22	V20-T22 PolarHBondContact O-N 3.28Å
21	G	34.8	Very low	45.9	Very low	73 Å²	73	126.5 Å²	126.5	75%	0.753	72%	0.715	S	S	*	*			trans	-58.4	116.8	162.7	0	0	0	0	0	110.3	S23	G21-S23 VanDerWaalsContact C-N 3.32Å; G21-S23 PolarHBondContact O-N 2.87Å
22	T	40.2	Very low	47.8	Very low	137 Å²	137	123.6 Å²	123.6	84%	0.84	70%	0.699	S	S	*	*			trans	-64.9	98.2	155.8	43.3	0	0	0	0	106.7	V20 G24	V20-T22 PolarHBondContact O-N 3.28Å; T22-G24 PolarHBondContact O-N 3.33Å
23	S	44	Very low	49.7	Very low	93 Å²	93	120.2 Å²	120.2	65%	0.65	68%	0.68	S	S	*	*			trans	-61.9	96.4	163.3	56.8	0	0	0	0	106.7	G21 W25	G21-S23 VanDerWaalsContact C-N 3.32Å; G21-S23 PolarHBondContact O-N 2.87Å; S23-W25 PolarHBondContact O-N 3.03Å
24	G	43.4	Very low	51.7	Low	67 Å²	67	115.5 Å²	115.5	69%	0.691	66%	0.664	S	S	*	*			trans	-59.1	104.3	169.7	0	0	0	0	0	107.2	T22 T26	T22-G24 PolarHBondContact O-N 3.33Å; G24-T26 PolarHBondContact O-N 2.95Å
25	W	49.1	Very low	53.8	Low	157 Å²	157	111.4 Å²	111.4	60%	0.595	65%	0.651	S	S	*	*			trans	-56.3	113.9	167	-68.6	80.4	0	0	0	106	S23 E27 V29 F30 I33	S23-W25 PolarHBondContact O-N 3.03Å; W25-E27 PolarHBondContact O-N 2.84Å; W25-V29 HydrophobicContact CE3-CB 3.92Å; W25-V29 HydrophobicContact CE3-CG1 3.36Å; W25-V29 HydrophobicContact CZ3-CG1 3.48Å; W25-V29 VanDerWaalsContact CZ3-CG1 3.48Å; W25-F30 HydrophobicContact CB-CD2 3.88Å; W25-F30 HydrophobicContact CB-CE2 4.47Å; W25-F30 HydrophobicContact CG-CD2 4.38Å; W25-I33 HydrophobicContact CZ3-CD1 4.17Å
26	T	57.7	Low	55.7	Low	93 Å²	93	111.5 Å²	111.5	57%	0.571	64%	0.641	S	S	*	*			trans	-54.8	134.2	173.5	53.9	0	0	0	0	107.7	G24 P28 V29	G24-T26 PolarHBondContact O-N 2.95Å; T26-P28 WeakPolarHBondContact O-CD 3.14Å; T26-V29 PolarHBondContact O-N 3.36Å
27	E	64.7	Low	57.7	Low	162 Å²	162	111.6 Å²	111.6	76%	0.757	63%	0.628	S	S	*	*	H	α-helix	trans	-28.8	-44	175.6	-79.1	-98.6	151.4	0	0	115.7	W25 V29 F30 L31	W25-E27 PolarHBondContact O-N 2.84Å; E27-V29 VanDerWaalsContact C-N 3.31Å; E27-V29 PolarHBondContact O-N 3.07Å; E27-F30 PolarHBondContact O-N 3.05Å; E27-L31 PolarHBondContact O-N 3.43Å; E27-L31 VanDerWaalsContact O-N 3.15Å
28	P	69.1	Low	59.7	Low	85 Å²	85	103.4 Å²	103.4	55%	0.552	61%	0.605	S	S	*	*	H	α-helix	trans	-62.1	-34.3	-179.1	-21	32.6	0	0	0	114.1	T26 L31 C32	T26-P28 WeakPolarHBondContact O-CD 3.14Å; P28-L31 PolarHBondContact O-N 3.2Å; P28-C32 PolarHBondContact O-N 3.39Å; P28-C32 VanDerWaalsContact O-N 3.07Å; P28-C32 PolarHBondContact O-SG 3.08Å; P28-C32 VanDerWaalsContact O-SG 3.36Å
29	V	69.2	Low	61.6	Low	56 Å²	56	99 Å²	99	34%	0.339	58%	0.579	S	S	.	*	H	α-helix	trans	-77.7	-35.5	-174.9	-170.1	0	0	0	0	110.8	W25 T26 E27 L31 C32 I33	W25-V29 HydrophobicContact CE3-CB 3.92Å; W25-V29 HydrophobicContact CE3-CG1 3.36Å; W25-V29 HydrophobicContact CZ3-CG1 3.48Å; W25-V29 VanDerWaalsContact CZ3-CG1 3.48Å; T26-V29 PolarHBondContact O-N 3.36Å; E27-V29 VanDerWaalsContact C-N 3.31Å; E27-V29 PolarHBondContact O-N 3.07Å; V29-L31 VanDerWaalsContact C-N 3.3Å; V29-L31 PolarHBondContact O-N 3.15Å; V29-C32 PolarHBondContact O-N 3.15Å; V29-I33 HydrophobicContact CG1-CD1 4.27Å; V29-I33 WeakPolarHBondContact O-CG1 3.42Å; V29-I33 PolarHBondContact O-N 3.42Å; V29-I33 VanDerWaalsContact O-N 3.15Å
30	F	68.9	Low	63.1	Low	125 Å²	125	95.2 Å²	95.2	55%	0.548	57%	0.565	S	S	.	*	H	α-helix	trans	-64.3	-38.4	172.4	-129.3	-92.1	0	0	0	111.1	W25 E27 N34	W25-F30 HydrophobicContact CB-CD2 3.88Å; W25-F30 HydrophobicContact CB-CE2 4.47Å; W25-F30 HydrophobicContact CG-CD2 4.38Å; E27-F30 PolarHBondContact O-N 3.05Å; F30-N34 WeakPolarHBondContact CD1-ND2 3.47Å; F30-N34 PolarHBondContact O-N 3.47Å; F30-N34 PolarHBondContact O-ND2 3.44Å
31	L	73.5	Confident	64.6	Low	108 Å²	108	94.9 Å²	94.9	57%	0.565	56%	0.559	S	S	*	*	H	α-helix	trans	-65.7	-44.4	176.6	-136.1	99.9	0	0	0	112.1	E27 P28 V29 I33 N34 L35	E27-L31 PolarHBondContact O-N 3.43Å; E27-L31 VanDerWaalsContact O-N 3.15Å; P28-L31 PolarHBondContact O-N 3.2Å; V29-L31 VanDerWaalsContact C-N 3.3Å; V29-L31 PolarHBondContact O-N 3.15Å; L31-I33 PolarHBondContact O-N 3.5Å; L31-N34 PolarHBondContact O-N 3.22Å; L31-L35 HydrophobicContact CD2-CD1 4.38Å; L31-L35 WeakPolarHBondContact O-CG 3.38Å; L31-L35 PolarHBondContact O-N 2.95Å
32	C	74.5	Confident	66.1	Low	74 Å²	74	96.3 Å²	96.3	50%	0.5	55%	0.549	S	S	.	.	H	α-helix	trans	-63.5	-41.3	179.6	-74.7	0	0	0	0	113	P28 V29 L35 L36	P28-C32 PolarHBondContact O-N 3.39Å; P28-C32 VanDerWaalsContact O-N 3.07Å; P28-C32 PolarHBondContact O-SG 3.08Å; P28-C32 VanDerWaalsContact O-SG 3.36Å; V29-C32 PolarHBondContact O-N 3.15Å; C32-L35 PolarHBondContact O-N 3.46Å; C32-L36 WeakPolarHBondContact O-CG 3.4Å; C32-L36 PolarHBondContact O-N 3.18Å; C32-L36 VanDerWaalsContact O-N 3.08Å
33	I	74.7	Confident	66.8	Low	80 Å²	80	94.7 Å²	94.7	41%	0.41	53%	0.534	S	S	.	.	H	α-helix	trans	-66.8	-43.2	177.9	-66.2	170	0	0	0	110.4	W25 V29 L31 L35 L36 V37	W25-I33 HydrophobicContact CZ3-CD1 4.17Å; V29-I33 HydrophobicContact CG1-CD1 4.27Å; V29-I33 WeakPolarHBondContact O-CG1 3.42Å; V29-I33 PolarHBondContact O-N 3.42Å; V29-I33 VanDerWaalsContact O-N 3.15Å; L31-I33 PolarHBondContact O-N 3.5Å; I33-L35 VanDerWaalsContact C-N 3.35Å; I33-L35 PolarHBondContact O-N 3.38Å; I33-L36 PolarHBondContact O-N 3.49Å; I33-V37 HydrophobicContact CG2-CG2 4.44Å; I33-V37 WeakPolarHBondContact O-CG2 3.39Å; I33-V37 PolarHBondContact O-N 3.4Å
34	N	76.1	Confident	67.6	Low	83 Å²	83	95.2 Å²	95.2	44%	0.444	53%	0.533	S	S	.	.	H	α-helix	trans	-64.4	-38.6	177.4	-79.5	-67.6	0	0	0	112.2	F30 L31 L36 V37 V38	F30-N34 WeakPolarHBondContact CD1-ND2 3.47Å; F30-N34 PolarHBondContact O-N 3.47Å; F30-N34 PolarHBondContact O-ND2 3.44Å; L31-N34 PolarHBondContact O-N 3.22Å; N34-L36 VanDerWaalsContact C-N 3.34Å; N34-L36 PolarHBondContact O-N 2.8Å; N34-V37 PolarHBondContact O-N 2.67Å; N34-V38 WeakPolarHBondContact O-CB 3.25Å; N34-V38 VanDerWaalsContact O-CG2 3.25Å; N34-V38 WeakPolarHBondContact O-CG2 3.46Å; N34-V38 PolarHBondContact O-N 2.94Å
35	L	77.9	Confident	68.3	Low	115 Å²	115	96.2 Å²	96.2	60%	0.602	53%	0.53	S	S	*	.	H	α-helix	trans	-63.3	-37.9	174.1	-76.2	168.4	0	0	0	112.5	L31 C32 I33 G39	L31-L35 HydrophobicContact CD2-CD1 4.38Å; L31-L35 WeakPolarHBondContact O-CG 3.38Å; L31-L35 PolarHBondContact O-N 2.95Å; C32-L35 PolarHBondContact O-N 3.46Å; I33-L35 VanDerWaalsContact C-N 3.35Å; I33-L35 PolarHBondContact O-N 3.38Å; L35-G39 PolarHBondContact O-N 3.06Å
36	L	76.8	Confident	68.8	Low	129 Å²	129	94 Å²	94	68%	0.675	53%	0.533	S	S	*	.	H	α-helix	trans	-68.5	-40.4	175.5	-75.4	169.8	0	0	0	112.5	C32 I33 N34 S40	C32-L36 WeakPolarHBondContact O-CG 3.4Å; C32-L36 PolarHBondContact O-N 3.18Å; C32-L36 VanDerWaalsContact O-N 3.08Å; I33-L36 PolarHBondContact O-N 3.49Å; N34-L36 VanDerWaalsContact C-N 3.34Å; N34-L36 PolarHBondContact O-N 2.8Å; L36-S40 WeakPolarHBondContact O-CB 3.41Å; L36-S40 PolarHBondContact O-N 3.36Å; L36-S40 PolarHBondContact O-OG 2.92Å
37	V	77.4	Confident	68.4	Low	71 Å²	71	98.4 Å²	98.4	43%	0.43	54%	0.541	S	S	.	.	H	α-helix	trans	-68	-44.8	177.3	174.4	0	0	0	0	111.1	I33 N34 S40 L41	I33-V37 HydrophobicContact CG2-CG2 4.44Å; I33-V37 WeakPolarHBondContact O-CG2 3.39Å; I33-V37 PolarHBondContact O-N 3.4Å; N34-V37 PolarHBondContact O-N 2.67Å; V37-S40 WeakPolarHBondContact CA-OG 3.34Å; V37-S40 PolarHBondContact O-N 2.98Å; V37-S40 PolarHBondContact O-OG 2.86Å; V37-S40 VanDerWaalsContact O-OG 3.06Å; V37-L41 HydrophobicContact CG1-CD1 3.96Å; V37-L41 WeakPolarHBondContact O-CB 3.42Å; V37-L41 WeakPolarHBondContact O-CG 3.41Å; V37-L41 PolarHBondContact O-N 2.89Å
38	V	74.5	Confident	67.4	Low	79 Å²	79	98.6 Å²	98.6	48%	0.479	54%	0.539	S	S	.	.	H	α-helix	trans	-66.4	-40	176.5	175.5	0	0	0	0	110.8	N34 L41 L42	N34-V38 WeakPolarHBondContact O-CB 3.25Å; N34-V38 VanDerWaalsContact O-CG2 3.25Å; N34-V38 WeakPolarHBondContact O-CG2 3.46Å; N34-V38 PolarHBondContact O-N 2.94Å; V38-L41 PolarHBondContact O-N 3.2Å; V38-L42 HydrophobicContact CG1-CD1 3.96Å; V38-L42 WeakPolarHBondContact O-CB 3.41Å; V38-L42 WeakPolarHBondContact O-CG 3.45Å; V38-L42 PolarHBondContact O-N 3.48Å
39	G	72.4	Confident	66.1	Low	29 Å²	29	99.8 Å²	99.8	30%	0.299	55%	0.547	S	S	.	.	H	α-helix	trans	-64.2	-39	175.9	0	0	0	0	0	113.3	L35 L42 L43	L35-G39 PolarHBondContact O-N 3.06Å; G39-L42 PolarHBondContact O-N 3.31Å; G39-L43 WeakPolarHBondContact O-CB 3.47Å; G39-L43 WeakPolarHBondContact O-CG 3.38Å; G39-L43 PolarHBondContact O-N 2.93Å
40	S	69.9	Low	64.6	Low	62 Å²	62	107.2 Å²	107.2	43%	0.434	57%	0.57	S	S	.	*	H	α-helix	trans	-73.4	-36.5	175.9	43.8	0	0	0	0	112.6	L36 V37 L43 V44	L36-S40 WeakPolarHBondContact O-CB 3.41Å; L36-S40 PolarHBondContact O-N 3.36Å; L36-S40 PolarHBondContact O-OG 2.92Å; V37-S40 WeakPolarHBondContact CA-OG 3.34Å; V37-S40 PolarHBondContact O-N 2.98Å; V37-S40 PolarHBondContact O-OG 2.86Å; V37-S40 VanDerWaalsContact O-OG 3.06Å; S40-L43 PolarHBondContact O-N 3.43Å; S40-V44 WeakPolarHBondContact O-CG2 3.22Å; S40-V44 PolarHBondContact O-N 2.82Å
41	L	68.2	Low	63.4	Low	115 Å²	115	105.8 Å²	105.8	60%	0.602	58%	0.576	S	S	*	*	H	α-helix	trans	-65.3	-38.5	171	-74.7	167.1	0	0	0	112.2	V37 V38 V44 S45	V37-L41 HydrophobicContact CG1-CD1 3.96Å; V37-L41 WeakPolarHBondContact O-CB 3.42Å; V37-L41 WeakPolarHBondContact O-CG 3.41Å; V37-L41 PolarHBondContact O-N 2.89Å; V38-L41 PolarHBondContact O-N 3.2Å; L41-V44 PolarHBondContact O-N 2.77Å; L41-S45 WeakPolarHBondContact O-CB 3.38Å; L41-S45 PolarHBondContact O-N 2.88Å
42	L	65.7	Low	62	Low	103 Å²	103	104.6 Å²	104.6	54%	0.539	58%	0.576	S	S	.	*	H	α-helix	trans	-65.8	-41	172.5	-81.6	164.3	0	0	0	111.4	V38 G39 V44 S45 V46	V38-L42 HydrophobicContact CG1-CD1 3.96Å; V38-L42 WeakPolarHBondContact O-CB 3.41Å; V38-L42 WeakPolarHBondContact O-CG 3.45Å; V38-L42 PolarHBondContact O-N 3.48Å; G39-L42 PolarHBondContact O-N 3.31Å; L42-V44 PolarHBondContact O-N 2.9Å; L42-S45 CarbonylContact O-C 3.6Å; L42-S45 PolarHBondContact O-N 3.5Å; L42-V46 WeakPolarHBondContact O-CB 3.37Å; L42-V46 VanDerWaalsContact O-CG2 3.22Å; L42-V46 WeakPolarHBondContact O-CG2 3.4Å; L42-V46 PolarHBondContact O-N 2.87Å
43	L	56.6	Low	60.5	Low	102 Å²	102	106.2 Å²	106.2	53%	0.534	58%	0.584	S	S	.	*	H	α-helix	trans	-61.9	-41.9	174	-83.4	162.8	0	0	0	111.7	G39 S40 S45 V46 Y47	G39-L43 WeakPolarHBondContact O-CB 3.47Å; G39-L43 WeakPolarHBondContact O-CG 3.38Å; G39-L43 PolarHBondContact O-N 2.93Å; S40-L43 PolarHBondContact O-N 3.43Å; L43-S45 VanDerWaalsContact C-N 3.34Å; L43-V46 PolarHBondContact O-N 3.14Å; L43-Y47 HydrophobicContact CD2-CD2 4.17Å; L43-Y47 HydrophobicContact CD2-CE2 4.12Å; L43-Y47 WeakPolarHBondContact O-CB 3.22Å; L43-Y47 PolarHBondContact O-N 3.4Å
44	V	60.5	Low	59.1	Low	104 Å²	104	105 Å²	105	63%	0.63	58%	0.582	S	S	*	*	H	α-helix	trans	-67.7	-34.1	174.4	174.7	0	0	0	0	111.9	S40 L41 L42 Y47 K48	S40-V44 WeakPolarHBondContact O-CG2 3.22Å; S40-V44 PolarHBondContact O-N 2.82Å; L41-V44 PolarHBondContact O-N 2.77Å; L42-V44 PolarHBondContact O-N 2.9Å; V44-Y47 CarbonylContact O-C 3.49Å; V44-K48 PolarHBondContact O-N 3.35Å; V44-K48 VanDerWaalsContact O-N 3.14Å
45	S	57.8	Low	57.8	Low	88 Å²	88	105.1 Å²	105.1	62%	0.615	59%	0.589	S	S	*	*	H	α-helix	trans	-70	-33.6	174.8	-176.5	0	0	0	0	112.9	L41 L42 L43	L41-S45 WeakPolarHBondContact O-CB 3.38Å; L41-S45 PolarHBondContact O-N 2.88Å; L42-S45 CarbonylContact O-C 3.6Å; L42-S45 PolarHBondContact O-N 3.5Å; L43-S45 VanDerWaalsContact C-N 3.34Å
46	V	59.4	Low	56.5	Low	110 Å²	110	102.8 Å²	102.8	67%	0.667	58%	0.583	S	S	*	*	H	α-helix	trans	-84.3	-30.6	178.2	176.4	0	0	0	0	111	L42 L43	L42-V46 WeakPolarHBondContact O-CB 3.37Å; L42-V46 VanDerWaalsContact O-CG2 3.22Å; L42-V46 WeakPolarHBondContact O-CG2 3.4Å; L42-V46 PolarHBondContact O-N 2.87Å; L43-V46 PolarHBondContact O-N 3.14Å
47	Y	48.2	Very low	55.8	Low	186 Å²	186	98.3 Å²	98.3	73%	0.729	56%	0.563	S	S	*	*			trans	-94.1	26.4	173.2	-83.8	-88.3	0	0	0	113.6	L43 V44 P49	L43-Y47 HydrophobicContact CD2-CD2 4.17Å; L43-Y47 HydrophobicContact CD2-CE2 4.12Å; L43-Y47 WeakPolarHBondContact O-CB 3.22Å; L43-Y47 PolarHBondContact O-N 3.4Å; V44-Y47 CarbonylContact O-C 3.49Å; Y47-P49 WeakPolarHBondContact O-CD 3.08Å
48	K	43.5	Very low	55.3	Low	167 Å²	167	95.4 Å²	95.4	73%	0.726	55%	0.545	S	S	*	.	S	Bend	trans	-67.4	110.6	149.1	-107.1	-176.2	178	179.9	0	104.9	V44 Y50	V44-K48 PolarHBondContact O-N 3.35Å; V44-K48 VanDerWaalsContact O-N 3.14Å; K48-Y50 VanDerWaalsContact C-N 3.34Å; K48-Y50 PolarHBondContact O-N 2.81Å
49	P	42.8	Very low	54.5	Low	110 Å²	110	94.5 Å²	94.5	71%	0.714	54%	0.536	S	S	*	.			trans	-57.4	112.8	170.5	25.1	-30.1	0	0	0	104.8	Y47 S51	Y47-P49 WeakPolarHBondContact O-CD 3.08Å; P49-S51 PolarHBondContact O-N 2.79Å
50	Y	38.3	Very low	53.9	Low	212 Å²	212	98 Å²	98	83%	0.831	56%	0.555	S	S	*	*			trans	-67.5	79.5	165.4	-156.6	-94.3	0	0	0	103.9	K48 S52	K48-Y50 VanDerWaalsContact C-N 3.34Å; K48-Y50 PolarHBondContact O-N 2.81Å; Y50-S52 PolarHBondContact O-N 2.74Å
51	S	43.2	Very low	53.6	Low	95 Å²	95	98.9 Å²	98.9	66%	0.664	56%	0.555	S	S	*	*			trans	-70.7	71.4	166.3	46.7	0	0	0	0	105.9	P49 V53	P49-S51 PolarHBondContact O-N 2.79Å; S51-V53 PolarHBondContact O-N 2.84Å
52	S	43.2	Very low	54.1	Low	82 Å²	82	93.7 Å²	93.7	57%	0.573	53%	0.527	S	S	*	.			trans	-63.1	74.7	149.5	57.4	0	0	0	0	106.3	Y50 S54	Y50-S52 PolarHBondContact O-N 2.74Å; S52-S54 PolarHBondContact O-N 2.77Å
53	V	44.2	Very low	54.1	Low	108 Å²	108	89.4 Å²	89.4	66%	0.655	51%	0.508	S	S	*	.			trans	-62.6	89.1	151.5	174.1	0	0	0	0	102.7	S51 S57	S51-V53 PolarHBondContact O-N 2.84Å; V53-S57 WeakPolarHBondContact CG1-OG 2.94Å
54	S	45	Very low	54	Low	55 Å²	55	85.3 Å²	85.3	39%	0.385	49%	0.486	S	S	.	.			trans	-53	146	-174.8	51.2	0	0	0	0	108.5	S52 S56 S57	S52-S54 PolarHBondContact O-N 2.77Å; S54-S56 WeakPolarHBondContact CB-OG 3.34Å; S54-S56 PolarHBondContact O-N 2.95Å; S54-S56 PolarHBondContact OG-OG 2.93Å; S54-S57 WeakPolarHBondContact O-CB 3.37Å; S54-S57 PolarHBondContact O-N 2.75Å; S54-S57 PolarHBondContact O-OG 2.81Å
55	S	48.3	Very low	53.3	Low	85 Å²	85	83 Å²	83	59%	0.594	48%	0.479	S	S	*	.	H	α-helix	trans	-48.8	-25.4	171.3	53.1	0	0	0	0	112.7	S57 C58 Q59	S55-S57 VanDerWaalsContact C-N 3.29Å; S55-S57 PolarHBondContact O-N 3.23Å; S55-C58 PolarHBondContact O-N 3.36Å; S55-Q59 WeakPolarHBondContact O-CG 3.41Å; S55-Q59 PolarHBondContact O-N 2.62Å
56	S	51.3	Low	52.4	Low	66 Å²	66	82.1 Å²	82.1	46%	0.462	47%	0.469	S	S	.	.	H	α-helix	trans	-62.4	-25.5	172.1	64.1	0	0	0	0	115.1	S54 S60	S54-S56 WeakPolarHBondContact CB-OG 3.34Å; S54-S56 PolarHBondContact O-N 2.95Å; S54-S56 PolarHBondContact OG-OG 2.93Å; S56-S60 PolarHBondContact O-N 2.7Å
57	S	62.2	Low	51.4	Low	36 Å²	36	82 Å²	82	25%	0.252	47%	0.469	S	S	.	.	H	α-helix	trans	-70.5	-41.1	177.5	65.2	0	0	0	0	112.4	V53 S54 S55 S60 L61	V53-S57 WeakPolarHBondContact CG1-OG 2.94Å; S54-S57 WeakPolarHBondContact O-CB 3.37Å; S54-S57 PolarHBondContact O-N 2.75Å; S54-S57 PolarHBondContact O-OG 2.81Å; S55-S57 VanDerWaalsContact C-N 3.29Å; S55-S57 PolarHBondContact O-N 3.23Å; S57-S60 PolarHBondContact O-N 3.49Å; S57-L61 WeakPolarHBondContact O-CB 2.99Å; S57-L61 WeakPolarHBondContact O-CD1 3.03Å; S57-L61 WeakPolarHBondContact O-CG 3.5Å; S57-L61 PolarHBondContact O-N 3.32Å
58	C	66	Low	50.8	Low	10 Å²	10	80.7 Å²	80.7	7%	0.068	48%	0.475	C	S	.	.	H	α-helix	trans	-67.7	-38.6	179.1	178.9	0	0	0	0	111.5	S55 L61 Y62 C312	S55-C58 PolarHBondContact O-N 3.36Å; C58-L61 PolarHBondContact O-N 3.01Å; C58-Y62 PolarHBondContact O-N 3.48Å; C58-C312 HydrophobicContact CB-CB 3.96Å; C58-C312 WeakPolarHBondContact CB-SG 3.05Å; C58-C312 WeakPolarHBondContact SG-CA 2.98Å; C58-C312 WeakPolarHBondContact SG-CB 2.77Å; C58-C312 CovalentContact SG-SG 2.03Å; C58-C312 PolarHBondContact SG-SG 2.67Å
59	Q	58.2	Low	50.2	Low	60 Å²	60	79 Å²	79	28%	0.28	47%	0.472	S	S	.	.	H	α-helix	trans	-58.7	-47.8	173.8	-64.8	-170.8	-5.8	0	0	112.4	S55 L61 G63 I64 T66	S55-Q59 WeakPolarHBondContact O-CG 3.41Å; S55-Q59 PolarHBondContact O-N 2.62Å; Q59-L61 VanDerWaalsContact C-N 3.33Å; Q59-L61 PolarHBondContact O-N 3.36Å; Q59-G63 VanDerWaalsContact O-CA 3.24Å; Q59-G63 WeakPolarHBondContact O-CA 3.46Å; Q59-G63 PolarHBondContact O-N 2.89Å; Q59-I64 WeakPolarHBondContact CA-O 3.43Å; Q59-I64 WeakPolarHBondContact CB-O 3.22Å; Q59-I64 WeakPolarHBondContact CG-O 3.02Å; Q59-I64 PolarHBondContact O-N 3.43Å; Q59-T66 HydrophobicContact CG-CG2 3.92Å; Q59-T66 VanDerWaalsContact NE2-CB 3.31Å; Q59-T66 PolarHBondContact NE2-OG1 3.05Å
60	S	59	Low	50.1	Low	101 Å²	101	80.1 Å²	80.1	71%	0.706	48%	0.479	S	S	*	.	H	α-helix	trans	-66.2	-35.4	179.2	-172.1	0	0	0	0	112.3	S56 S57	S56-S60 PolarHBondContact O-N 2.7Å; S57-S60 PolarHBondContact O-N 3.49Å
61	L	63.8	Low	50.2	Low	81 Å²	81	73.2 Å²	73.2	42%	0.424	46%	0.462	S	S	.	.	H	α-helix	trans	-78	-40.5	-175.1	-74.4	166.7	0	0	0	113.2	S57 C58 Q59 V246	S57-L61 WeakPolarHBondContact O-CB 2.99Å; S57-L61 WeakPolarHBondContact O-CD1 3.03Å; S57-L61 WeakPolarHBondContact O-CG 3.5Å; S57-L61 PolarHBondContact O-N 3.32Å; C58-L61 PolarHBondContact O-N 3.01Å; Q59-L61 VanDerWaalsContact C-N 3.33Å; Q59-L61 PolarHBondContact O-N 3.36Å; L61-V246 WeakPolarHBondContact O-CG1 3.23Å
62	Y	79.2	Confident	49.7	Very low	7 Å²	7	72 Å²	72	3%	0.027	46%	0.464	C	S	.	.	H	α-helix	trans	-117.3	4.2	-173.8	-55.9	-55.4	0	0	0	114.4	C58 I64 W248 A251 F313	C58-Y62 PolarHBondContact O-N 3.48Å; Y62-I64 VanDerWaalsContact C-N 3.3Å; Y62-I64 HydrophobicContact CD2-CD1 4.27Å; Y62-W248 AromaticContact CD1-CD1 3.78Å; Y62-W248 HydrophobicContact CD1-CD2 4.34Å; Y62-W248 HydrophobicContact CD1-CG 4.06Å; Y62-W248 AromaticContact CD1-NE1 3.88Å; Y62-W248 PolarHBondContact O-NE1 3.04Å; Y62-A251 HydrophobicContact CD1-CB 4.22Å; Y62-A251 HydrophobicContact CE1-CB 3.46Å; Y62-A251 VanDerWaalsContact CE1-CB 3.46Å; Y62-A251 PolarHBondContact OH-N 2.03Å; Y62-F313 HydrophobicContact CD2-CD2 4.19Å; Y62-F313 HydrophobicContact CE1-CD2 4.41Å; Y62-F313 AromaticContact CE2-CD2 3.88Å; Y62-F313 HydrophobicContact CE2-CD2 3.88Å; Y62-F313 AromaticContact CZ-CD2 3.98Å
63	G	64.7	Low	49.4	Very low	12 Å²	12	72.6 Å²	72.6	12%	0.124	46%	0.461	C	S	.	.			trans	71.9	23.5	-177.8	0	0	0	0	0	113.7	Q59 Y211	Q59-G63 VanDerWaalsContact O-CA 3.24Å; Q59-G63 WeakPolarHBondContact O-CA 3.46Å; Q59-G63 PolarHBondContact O-N 2.89Å; G63-Y211 PolarHBondContact O-OH 3.34Å
64	I	55.5	Low	48.9	Very low	16 Å²	16	74.1 Å²	74.1	8%	0.082	46%	0.464	C	S	.	.	P	Polyproline II helix	trans	-79.7	137.9	178.6	-63.6	163.6	0	0	0	108.4	Q59 Y62 A311	Q59-I64 WeakPolarHBondContact CA-O 3.43Å; Q59-I64 WeakPolarHBondContact CB-O 3.22Å; Q59-I64 WeakPolarHBondContact CG-O 3.02Å; Q59-I64 PolarHBondContact O-N 3.43Å; Y62-I64 VanDerWaalsContact C-N 3.3Å; Y62-I64 HydrophobicContact CD2-CD1 4.27Å; I64-A311 HydrophobicContact CD1-CB 4.34Å; I64-A311 WeakPolarHBondContact CD1-O 3.41Å
65	A	45.2	Very low	48.5	Very low	57 Å²	57	76.1 Å²	76.1	47%	0.471	48%	0.477	S	S	.	.	P	Polyproline II helix	trans	-93.8	132.3	159.2	0	0	0	0	0	106.5	T67	A65-T67 PolarHBondContact O-N 2.67Å
66	T	38.7	Very low	48	Very low	68 Å²	68	76.2 Å²	76.2	42%	0.417	48%	0.483	S	S	.	.	P	Polyproline II helix	trans	-65.1	134.2	169.8	53.6	0	0	0	0	107.8	Q59 D68	Q59-T66 HydrophobicContact CG-CG2 3.92Å; Q59-T66 VanDerWaalsContact NE2-CB 3.31Å; Q59-T66 PolarHBondContact NE2-OG1 3.05Å; T66-D68 PolarHBondContact O-N 2.94Å
67	T	37.9	Very low	47.3	Very low	109 Å²	109	77.9 Å²	77.9	67%	0.669	49%	0.49	S	S	*	.	P	Polyproline II helix	trans	-55.4	126.3	171.9	49.4	0	0	0	0	110.9	A65	A65-T67 PolarHBondContact O-N 2.67Å
68	D	36.4	Very low	46	Very low	158 Å²	158	82.3 Å²	82.3	85%	0.845	52%	0.516	S	S	*	.			trans	-155.3	49.9	153.2	-91.3	-24.9	0	0	0	109.5	T66	T66-D68 PolarHBondContact O-N 2.94Å
69	I	31.7	Very low	44.5	Very low	131 Å²	131	90.6 Å²	90.6	67%	0.672	55%	0.55	S	S	*	*			trans	-140.9	119.4	155.2	-48.4	179.5	0	0	0	105.7	S71	I69-S71 PolarHBondContact O-N 2.92Å
70	P	40.3	Very low	43.4	Very low	133 Å²	133	96.2 Å²	96.2	86%	0.864	58%	0.577	S	S	*	*			trans	-68.7	74.5	154.3	29.2	-27	0	0	0	105.9	G72	P70-G72 VanDerWaalsContact C-N 3.32Å; P70-G72 PolarHBondContact O-N 3.11Å
71	S	40	Very low	42.3	Very low	67 Å²	67	95.1 Å²	95.1	47%	0.469	57%	0.569	S	S	.	*			trans	-64.9	108.7	164.3	-23.8	0	0	0	0	102.6	I69 N73	I69-S71 PolarHBondContact O-N 2.92Å; S71-N73 PolarHBondContact O-N 3.12Å
72	G	33.3	Very low	41.4	Very low	69 Å²	69	98.9 Å²	98.9	71%	0.711	59%	0.59	S	S	*	*			trans	-59.3	70.9	153.8	0	0	0	0	0	107.8	P70 I74	P70-G72 VanDerWaalsContact C-N 3.32Å; P70-G72 PolarHBondContact O-N 3.11Å; G72-I74 PolarHBondContact O-N 3.22Å
73	N	36.8	Very low	39.8	Very low	96 Å²	96	104.8 Å²	104.8	51%	0.513	62%	0.622	S	S	.	*			trans	-71.8	93.8	155.3	-78.9	-4.3	0	0	0	102.8	S71 C75 D208	S71-N73 PolarHBondContact O-N 3.12Å; N73-C75 PolarHBondContact O-N 3.17Å; N73-D208 PolarHBondContact ND2-OD1 2.71Å; N73-D208 PolarHBondContact ND2-OD2 2.78Å
74	I	32.6	Very low	38.9	Very low	140 Å²	140	112.2 Å²	112.2	72%	0.718	65%	0.653	S	S	*	*			trans	-41.5	95.5	153.6	-60.6	162.8	0	0	0	103.9	G72 A76	G72-I74 PolarHBondContact O-N 3.22Å; I74-A76 VanDerWaalsContact C-N 3.28Å; I74-A76 PolarHBondContact O-N 2.89Å
75	C	38.4	Very low	38.9	Very low	97 Å²	97	117.7 Å²	117.7	66%	0.655	67%	0.673	S	S	*	*			trans	-40.3	117	140.1	-80.2	0	0	0	0	101.7	N73 T77	N73-C75 PolarHBondContact O-N 3.17Å; C75-T77 VanDerWaalsContact O-CA 3.32Å; C75-T77 WeakPolarHBondContact O-CA 3.33Å; C75-T77 PolarHBondContact O-N 2.66Å; C75-T77 PolarHBondContact O-OG1 3.44Å
76	A	37.8	Very low	40.3	Very low	86 Å²	86	118.1 Å²	118.1	71%	0.711	67%	0.672	S	S	*	*			trans	-41.3	102.9	166.9	0	0	0	0	0	103.1	I74 V78	I74-A76 VanDerWaalsContact C-N 3.28Å; I74-A76 PolarHBondContact O-N 2.89Å; A76-V78 PolarHBondContact O-N 3.4Å
77	T	35.1	Very low	42.8	Very low	101 Å²	101	116.3 Å²	116.3	62%	0.62	66%	0.66	S	S	*	*			trans	-69.7	102.8	-173.9	-60	0	0	0	0	96.7	C75 K79	C75-T77 VanDerWaalsContact O-CA 3.32Å; C75-T77 WeakPolarHBondContact O-CA 3.33Å; C75-T77 PolarHBondContact O-N 2.66Å; C75-T77 PolarHBondContact O-OG1 3.44Å; T77-K79 WeakPolarHBondContact O-CA 3.45Å; T77-K79 PolarHBondContact O-N 2.82Å
78	V	36.3	Very low	45.5	Very low	129 Å²	129	117.2 Å²	117.2	78%	0.782	65%	0.653	S	S	*	*			trans	-45.8	102.6	161.5	173.7	0	0	0	0	100.6	A76 Q80	A76-V78 PolarHBondContact O-N 3.4Å; V78-Q80 PolarHBondContact O-N 2.91Å
79	K	33.5	Very low	48.4	Very low	184 Å²	184	110.8 Å²	110.8	80%	0.8	62%	0.616	S	S	*	*			trans	-54.9	118.7	-172.3	-87.1	-175.9	174.9	179.5	0	101.8	T77 S81	T77-K79 WeakPolarHBondContact O-CA 3.45Å; T77-K79 PolarHBondContact O-N 2.82Å; K79-S81 PolarHBondContact O-N 3.49Å
80	Q	34.8	Very low	51.6	Low	178 Å²	178	108 Å²	108	83%	0.832	60%	0.597	S	S	*	*			trans	-66.8	83.1	176	-162.4	179	1.6	0	0	104.2	V78 D82	V78-Q80 PolarHBondContact O-N 2.91Å; Q80-D82 PolarHBondContact O-N 3.11Å
81	S	37	Very low	54.3	Low	79 Å²	79	101.6 Å²	101.6	55%	0.552	56%	0.556	S	S	*	*			trans	-60.8	124.2	153.8	49.7	0	0	0	0	103.7	K79 D83	K79-S81 PolarHBondContact O-N 3.49Å; S81-D83 PolarHBondContact O-N 3.48Å
82	D	44.5	Very low	57.1	Low	159 Å²	159	98.4 Å²	98.4	85%	0.85	53%	0.534	S	S	*	.	S	Bend	trans	-57.3	-4.8	171.9	-114.5	-13	0	0	0	112.5	Q80 Q84	Q80-D82 PolarHBondContact O-N 3.11Å; D82-Q84 PolarHBondContact O-N 3.35Å; D82-Q84 VanDerWaalsContact O-N 3.11Å
83	D	44.5	Very low	60.3	Low	131 Å²	131	95.1 Å²	95.1	70%	0.701	50%	0.5	S	S	*	.	S	Bend	trans	-71.7	99.8	165.1	-89.3	-24.1	0	0	0	110.7	S81	S81-D83 PolarHBondContact O-N 3.48Å
84	Q	46.2	Very low	63.2	Low	168 Å²	168	90.6 Å²	90.6	79%	0.785	48%	0.476	S	S	*	.			trans	48.3	97.7	150.3	-57.8	-74.6	-37.8	0	0	113.5	D82 S86	D82-Q84 PolarHBondContact O-N 3.35Å; D82-Q84 VanDerWaalsContact O-N 3.11Å; Q84-S86 PolarHBondContact O-N 3.09Å
85	R	55.6	Low	66.3	Low	131 Å²	131	83.9 Å²	83.9	49%	0.494	44%	0.441	S	S	.	.			trans	-53.9	93	160.3	-176.3	177	177.3	178.5	-4.8	108.1	N87 M125 L338	R85-N87 PolarHBondContact O-N 3.49Å; R85-M125 VanDerWaalsContact NH2-CE 3.33Å; R85-L338 HydrophobicContact CG-CD1 4.19Å; R85-L338 VanDerWaalsContact NH2-C 3.31Å; R85-L338 PolarHBondContact NH2-O 3.19Å
86	S	74.3	Confident	69.2	Low	66 Å²	66	79.3 Å²	79.3	46%	0.462	41%	0.41	S	S	.	.			trans	-63.6	121.4	179.3	175	0	0	0	0	106.9	Q84 Y88	Q84-S86 PolarHBondContact O-N 3.09Å; S86-Y88 PolarHBondContact O-N 3.02Å; S86-Y88 WeakPolarHBondContact OG-CB 2.81Å; S86-Y88 WeakPolarHBondContact OG-CD2 3.33Å; S86-Y88 PolarHBondContact OG-N 2.85Å
87	N	91.5	Very high	72	Confident	31 Å²	31	76.3 Å²	76.3	17%	0.166	38%	0.382	C	S	.	.			trans	-78.9	14.2	171.6	-64.4	-32.9	0	0	0	112	R85 Y89 R120 L121 A123	R85-N87 PolarHBondContact O-N 3.49Å; N87-Y89 WeakPolarHBondContact O-CE2 3.42Å; N87-R120 CarbonylContact O-C 3.57Å; N87-R120 VanDerWaalsContact O-CA 3.3Å; N87-R120 WeakPolarHBondContact O-CA 3.33Å; N87-L121 HydrophobicContact CB-CB 4.15Å; N87-L121 WeakPolarHBondContact CB-O 3.42Å; N87-L121 PolarHBondContact O-N 2.78Å; N87-A123 WeakPolarHBondContact ND2-CA 3.37Å
88	Y	95.8	Very high	74.9	Confident	128 Å²	128	73.6 Å²	73.6	50%	0.502	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	130.3	178.9	-60	-103.8	0	0	0	109.1	S86 I118 L119 R120	S86-Y88 PolarHBondContact O-N 3.02Å; S86-Y88 WeakPolarHBondContact OG-CB 2.81Å; S86-Y88 WeakPolarHBondContact OG-CD2 3.33Å; S86-Y88 PolarHBondContact OG-N 2.85Å; Y88-I118 HydrophobicContact CD1-CG2 3.84Å; Y88-I118 HydrophobicContact CG-CG2 4.46Å; Y88-L119 CarbonylContact C-O 3.5Å; Y88-L119 WeakPolarHBondContact CA-O 3.45Å; Y88-R120 HydrophobicContact CD1-CB 4Å; Y88-R120 HydrophobicContact CD1-CG 3.99Å; Y88-R120 HydrophobicContact CE1-CB 4.1Å; Y88-R120 HydrophobicContact CE1-CG 3.75Å; Y88-R120 HydrophobicContact CE2-CG 4.38Å; Y88-R120 HydrophobicContact CG-CG 4.44Å; Y88-R120 PolarHBondContact OH-NE 3.42Å
89	Y	97.4	Very high	77.7	Confident	22 Å²	22	73.4 Å²	73.4	9%	0.086	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	127.8	-179.5	-53.6	-92.5	0	0	0	108.2	N87 I118 L119 L121 I336 P337 L387	N87-Y89 WeakPolarHBondContact O-CE2 3.42Å; Y89-I118 CarbonylContact O-C 3.57Å; Y89-I118 WeakPolarHBondContact O-CA 3.26Å; Y89-L119 PolarHBondContact N-O 3Å; Y89-L119 PolarHBondContact O-N 3.38Å; Y89-L121 HydrophobicContact CE2-CB 4.48Å; Y89-L121 HydrophobicContact CE2-CD1 3.93Å; Y89-L121 HydrophobicContact CE2-CG 3.96Å; Y89-I336 HydrophobicContact CD1-CG2 4.34Å; Y89-I336 HydrophobicContact CD2-CG2 4.13Å; Y89-I336 HydrophobicContact CE1-CG2 3.98Å; Y89-I336 HydrophobicContact CE2-CG2 3.76Å; Y89-I336 HydrophobicContact CG-CG2 4.41Å; Y89-P337 HydrophobicContact CD1-CG 4.32Å; Y89-P337 HydrophobicContact CE1-CB 4.13Å; Y89-P337 HydrophobicContact CE1-CG 4.33Å; Y89-P337 PolarHBondContact OH-O 2.73Å; Y89-L387 HydrophobicContact CD1-CD2 4.14Å; Y89-L387 HydrophobicContact CG-CD2 4.05Å
90	R	97.4	Very high	80.7	Confident	72 Å²	72	71.2 Å²	71.2	27%	0.272	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	130.4	170	-176.9	68.8	178.2	157.2	-17.9	108	T116 G117 D133 L387 I388	R90-T116 PolarHBondContact NH2-OG1 3.44Å; R90-G117 WeakPolarHBondContact CD-O 3.29Å; R90-G117 VanDerWaalsContact NH1-C 3.29Å; R90-G117 VanDerWaalsContact NH1-CA 3.33Å; R90-G117 PolarHBondContact NH1-O 3.49Å; R90-D133 IonicContact CZ-OD1 2.59Å; R90-D133 IonicContact CZ-OD2 2.64Å; R90-D133 VanDerWaalsContact CZ-OD2 3.28Å; R90-D133 IonicContact NH1-OD1 3.83Å; R90-D133 PolarHBondContact NH1-OD1 2.94Å; R90-D133 IonicContact NH1-OD2 3.79Å; R90-D133 PolarHBondContact NH1-OD2 3.36Å; R90-D133 VanDerWaalsContact NH1-OD2 3.1Å; R90-D133 IonicContact NH2-OD1 2.67Å; R90-D133 IonicContact NH2-OD2 3.85Å; R90-D133 PolarHBondContact NH2-OD2 3.2Å; R90-L387 WeakPolarHBondContact O-CA 3.43Å; R90-I388 HydrophobicContact CB-CG1 4.14Å; R90-I388 WeakPolarHBondContact CB-O 3.46Å; R90-I388 HydrophobicContact CG-CD1 3.93Å; R90-I388 HydrophobicContact CG-CG1 3.54Å; R90-I388 PolarHBondContact O-N 3.18Å
91	I	98.5	Very high	83.7	Confident	0 Å²	0	62.8 Å²	62.8	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	154.2	180	62.4	166.5	0	0	0	110.5	T116 G117 L119 V130 W132 L360 E386 L387	I91-T116 CarbonylContact O-C 3.54Å; I91-T116 VanDerWaalsContact O-CA 3.31Å; I91-T116 WeakPolarHBondContact O-CA 3.15Å; I91-G117 PolarHBondContact N-O 3.42Å; I91-G117 PolarHBondContact O-N 3.29Å; I91-L119 HydrophobicContact CD1-CB 4.27Å; I91-L119 HydrophobicContact CG2-CB 3.89Å; I91-V130 HydrophobicContact CD1-CG2 3.92Å; I91-W132 HydrophobicContact CD1-CH2 3.71Å; I91-W132 HydrophobicContact CD1-CZ2 4.35Å; I91-W132 HydrophobicContact CD1-CZ3 4Å; I91-W132 HydrophobicContact CG1-CH2 4.49Å; I91-W132 HydrophobicContact CG1-CZ3 4.32Å; I91-L360 HydrophobicContact CD1-CD1 3.55Å; I91-E386 WeakPolarHBondContact CA-O 3.49Å; I91-L387 HydrophobicContact CG2-CD2 4.07Å; I91-L387 HydrophobicContact CG2-CG 4.02Å
92	V	98.6	Very high	86.6	Confident	0 Å²	0	64.6 Å²	64.6	0%	0	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	143.4	173.3	50.5	0	0	0	0	109.3	F114 Q115 T116 L155 I385 E386 I388	V92-F114 HydrophobicContact CB-CE1 4.3Å; V92-F114 HydrophobicContact CB-CZ 4.06Å; V92-F114 HydrophobicContact CG2-CD1 3.93Å; V92-F114 HydrophobicContact CG2-CD2 3.78Å; V92-F114 HydrophobicContact CG2-CE1 3.54Å; V92-F114 HydrophobicContact CG2-CE2 3.41Å; V92-F114 VanDerWaalsContact CG2-CE2 3.41Å; V92-F114 HydrophobicContact CG2-CG 4.05Å; V92-F114 HydrophobicContact CG2-CZ 3.29Å; V92-Q115 CarbonylContact C-O 3.45Å; V92-Q115 WeakPolarHBondContact CA-O 3.18Å; V92-T116 HydrophobicContact CB-CG2 4.25Å; V92-T116 HydrophobicContact CG2-CG2 4.34Å; V92-L155 HydrophobicContact CB-CD1 4.36Å; V92-L155 HydrophobicContact CG1-CD1 3.85Å; V92-L155 HydrophobicContact CG2-CD1 3.74Å; V92-I385 VanDerWaalsContact O-CA 3.28Å; V92-I385 WeakPolarHBondContact O-CA 3.47Å; V92-I385 WeakPolarHBondContact O-CG1 3.43Å; V92-E386 HydrophobicContact CG1-CB 3.94Å; V92-E386 WeakPolarHBondContact CG1-O 3.24Å; V92-E386 PolarHBondContact N-O 3.27Å; V92-E386 PolarHBondContact O-N 2.88Å; V92-I388 HydrophobicContact CB-CD1 4.27Å; V92-I388 HydrophobicContact CG1-CD1 4.21Å; V92-I388 HydrophobicContact CG1-CG1 4.43Å; V92-I388 HydrophobicContact CG1-CG2 3.76Å
93	V	98.8	Very high	89.1	Confident	0 Å²	0	58.4 Å²	58.4	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	147.5	165.8	-64.1	0	0	0	0	110.9	Q115 W132 V347 I376 F382 G384 I385	V93-Q115 HydrophobicContact CG2-CB 3.85Å; V93-Q115 HydrophobicContact CG2-CG 4.25Å; V93-Q115 PolarHBondContact N-O 2.81Å; V93-Q115 PolarHBondContact O-N 2.95Å; V93-W132 HydrophobicContact CG1-CH2 3.85Å; V93-W132 HydrophobicContact CG1-CZ3 4.34Å; V93-W132 HydrophobicContact CG2-CH2 3.95Å; V93-W132 HydrophobicContact CG2-CZ3 3.87Å; V93-V347 HydrophobicContact CG1-CG2 3.86Å; V93-I376 HydrophobicContact CG1-CD1 4.29Å; V93-I376 HydrophobicContact CG2-CD1 4.45Å; V93-I376 HydrophobicContact CG2-CG2 4.08Å; V93-F382 HydrophobicContact CB-CB 4.26Å; V93-F382 HydrophobicContact CB-CD1 3.78Å; V93-F382 HydrophobicContact CB-CE1 4.38Å; V93-F382 HydrophobicContact CB-CG 4.13Å; V93-F382 HydrophobicContact CG2-CB 4.47Å; V93-F382 HydrophobicContact CG2-CD1 3.48Å; V93-F382 VanDerWaalsContact CG2-CD1 3.48Å; V93-F382 HydrophobicContact CG2-CD2 4.32Å; V93-F382 HydrophobicContact CG2-CE1 3.66Å; V93-F382 HydrophobicContact CG2-CE2 4.42Å; V93-F382 HydrophobicContact CG2-CG 3.85Å; V93-F382 HydrophobicContact CG2-CZ 4.13Å; V93-G384 WeakPolarHBondContact CA-O 3.26Å; V93-G384 WeakPolarHBondContact CB-O 3.48Å; V93-I385 HydrophobicContact CG1-CB 4.09Å; V93-I385 HydrophobicContact CG1-CD1 4.09Å; V93-I385 HydrophobicContact CG1-CG1 4.05Å
94	I	98.7	Very high	91.4	Very high	0 Å²	0	59.4 Å²	59.4	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	145	179.8	-154.8	157	0	0	0	111.4	S112 I113 F114 L139 L152 L155 F382 E383 G384	I94-S112 WeakPolarHBondContact CG1-OG 3.47Å; I94-I113 WeakPolarHBondContact CA-O 3Å; I94-F114 HydrophobicContact CD1-CD2 4.34Å; I94-L139 HydrophobicContact CD1-CD1 3.62Å; I94-L139 HydrophobicContact CG1-CD1 4.37Å; I94-L152 HydrophobicContact CD1-CB 4.2Å; I94-L152 HydrophobicContact CD1-CD1 3.34Å; I94-L152 HydrophobicContact CD1-CG 4.4Å; I94-L152 HydrophobicContact CG1-CB 4.05Å; I94-L152 HydrophobicContact CG1-CD1 3.83Å; I94-L152 HydrophobicContact CG2-CB 4.14Å; I94-L155 HydrophobicContact CB-CD1 3.78Å; I94-L155 HydrophobicContact CB-CD2 4.35Å; I94-L155 HydrophobicContact CB-CG 3.92Å; I94-L155 HydrophobicContact CD1-CD2 3.91Å; I94-L155 HydrophobicContact CD1-CG 4.4Å; I94-L155 HydrophobicContact CG2-CD1 3.98Å; I94-L155 HydrophobicContact CG2-CD2 4.27Å; I94-L155 HydrophobicContact CG2-CG 3.63Å; I94-F382 VanDerWaalsContact C-CD1 3.47Å; I94-F382 WeakPolarHBondContact O-CA 3.38Å; I94-F382 WeakPolarHBondContact O-CD1 3.48Å; I94-E383 PolarHBondContact O-N 3.49Å; I94-G384 PolarHBondContact N-O 2.82Å; I94-G384 VanDerWaalsContact N-O 3.07Å; I94-G384 PolarHBondContact O-N 3Å
95	S	98.6	Very high	93.8	Very high	0 Å²	0	56 Å²	56	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	140.9	-172.8	72	0	0	0	0	114	L97 S112 I113 L152 K381	S95-L97 WeakPolarHBondContact OG-CG 3.25Å; S95-S112 PolarHBondContact N-OG 2.79Å; S95-S112 PolarHBondContact O-OG 2.98Å; S95-S112 PolarHBondContact OG-OG 3.08Å; S95-I113 PolarHBondContact N-O 2.83Å; S95-I113 WeakPolarHBondContact OG-CB 3.37Å; S95-I113 PolarHBondContact OG-N 3.14Å; S95-L152 CarbonylContact C-O 2.94Å; S95-L152 PolarHBondContact O-N 3.01Å; S95-K381 CarbonylContact C-O 3.6Å; S95-K381 WeakPolarHBondContact CA-O 3.48Å; S95-K381 WeakPolarHBondContact CB-O 3.26Å
96	D	98.2	Very high	95.7	Very high	1 Å²	1	54.3 Å²	54.3	1%	0.005	28%	0.278	C	S	.	.			trans	-97.6	113.4	152.4	-170.2	-33.3	0	0	0	107.4	D98 E151 K381 E383	D96-D98 WeakPolarHBondContact OD1-CA 3.19Å; D96-D98 PolarHBondContact OD1-N 3.37Å; D96-E151 WeakPolarHBondContact OD1-CB 3.38Å; D96-K381 PolarHBondContact N-O 3.24Å; D96-K381 VanDerWaalsContact O-CB 3.22Å; D96-K381 WeakPolarHBondContact O-CB 3.43Å; D96-K381 WeakPolarHBondContact O-CD 3.41Å; D96-K381 WeakPolarHBondContact O-CG 3.49Å; D96-K381 VanDerWaalsContact O-O 3.04Å; D96-E383 HydrophobicContact CB-CB 4.39Å; D96-E383 HydrophobicContact CB-CG 3.97Å; D96-E383 WeakPolarHBondContact CB-OE2 3.12Å
97	L	97.3	Very high	96.7	Very high	23 Å²	23	56 Å²	56	12%	0.12	29%	0.29	C	S	.	.			trans	-97.4	8.1	180	-61.2	179.1	0	0	0	112.4	S95 H99 D100 V111 I113 F380	S95-L97 WeakPolarHBondContact OG-CG 3.25Å; L97-H99 PolarHBondContact O-N 3.07Å; L97-D100 HydrophobicContact CB-CB 4.39Å; L97-D100 WeakPolarHBondContact O-CA 3.27Å; L97-D100 WeakPolarHBondContact O-CB 3.46Å; L97-D100 PolarHBondContact O-N 3.17Å; L97-V111 HydrophobicContact CD1-CG2 4.18Å; L97-I113 HydrophobicContact CD1-CG1 4.16Å; L97-I113 HydrophobicContact CD2-CG1 4.41Å; L97-F380 HydrophobicContact CD2-CB 4.15Å; L97-F380 HydrophobicContact CD2-CD1 3.71Å; L97-F380 HydrophobicContact CD2-CG 4.27Å
98	D	95.8	Very high	96.9	Very high	44 Å²	44	59.8 Å²	59.8	24%	0.235	31%	0.307	C	S	.	.	G	3₁₀ helix	trans	46.9	-127.6	-172.2	-75.1	-74.2	0	0	0	110.9	D96 D100 S101 R148 E151 K381	D96-D98 WeakPolarHBondContact OD1-CA 3.19Å; D96-D98 PolarHBondContact OD1-N 3.37Å; D98-D100 PolarHBondContact O-N 3.38Å; D98-S101 VanDerWaalsContact O-CB 3.28Å; D98-S101 WeakPolarHBondContact O-CB 3.17Å; D98-S101 PolarHBondContact O-N 2.91Å; D98-S101 PolarHBondContact O-OG 2.79Å; D98-R148 IonicContact OD1-NH2 2.58Å; D98-R148 PolarHBondContact OD1-NH2 2.87Å; D98-E151 WeakPolarHBondContact O-CG 3.46Å; D98-K381 IonicContact OD1-NZ 3.75Å; D98-K381 IonicContact OD2-NZ 3.96Å; D98-K381 PolarHBondContact OD2-NZ 2.87Å
99	H	95.2	Very high	97	Very high	124 Å²	124	54.7 Å²	54.7	57%	0.574	29%	0.289	S	S	*	.	G	3₁₀ helix	trans	-66.9	-20.9	179.5	-76.6	-83.7	0	0	0	114.1	L97 S101 R148	L97-H99 PolarHBondContact O-N 3.07Å; H99-S101 PolarHBondContact O-N 3.4Å; H99-R148 PolarHBondContact NE2-NH1 2.89Å
100	D	96.2	Very high	97.1	Very high	138 Å²	138	53.7 Å²	53.7	74%	0.738	29%	0.285	S	S	*	.	G	3₁₀ helix	trans	-81	-3.8	178.8	-66.8	-22.2	0	0	0	112.4	L97 D98 K102	L97-D100 HydrophobicContact CB-CB 4.39Å; L97-D100 WeakPolarHBondContact O-CA 3.27Å; L97-D100 WeakPolarHBondContact O-CB 3.46Å; L97-D100 PolarHBondContact O-N 3.17Å; D98-D100 PolarHBondContact O-N 3.38Å; D100-K102 PolarHBondContact O-N 2.86Å
101	S	97.6	Very high	97.1	Very high	1 Å²	1	51.1 Å²	51.1	1%	0.007	28%	0.277	C	S	.	.	G	3₁₀ helix	trans	-59	-24.3	168.1	61.5	0	0	0	0	112.3	D98 H99 N103 W110 V111 A149	D98-S101 VanDerWaalsContact O-CB 3.28Å; D98-S101 WeakPolarHBondContact O-CB 3.17Å; D98-S101 PolarHBondContact O-N 2.91Å; D98-S101 PolarHBondContact O-OG 2.79Å; H99-S101 PolarHBondContact O-N 3.4Å; S101-N103 PolarHBondContact O-N 3.05Å; S101-W110 CarbonylContact O-C 3.36Å; S101-W110 WeakPolarHBondContact O-CA 3.39Å; S101-V111 WeakPolarHBondContact O-CG2 3.49Å; S101-V111 PolarHBondContact O-N 2.85Å; S101-A149 WeakPolarHBondContact CB-O 3.31Å; S101-A149 PolarHBondContact OG-O 2.91Å
102	K	97.8	Very high	97.1	Very high	118 Å²	118	51.1 Å²	51.1	51%	0.513	28%	0.277	S	S	.	.	B	Isolated β-bridge	trans	-68.8	123.6	-177.8	-169.9	175.4	-177.8	179.3	0	111.6	D100 V104	D100-K102 PolarHBondContact O-N 2.86Å; K102-V104 PolarHBondContact O-N 2.82Å
103	N	97.1	Very high	97.1	Very high	28 Å²	28	51.5 Å²	51.5	15%	0.15	28%	0.279	C	S	.	.			trans	-65.3	124.7	178.2	-167.5	-56.3	0	0	0	111	S101 S105 K106 T109 V111	S101-N103 PolarHBondContact O-N 3.05Å; N103-S105 VanDerWaalsContact C-N 3.28Å; N103-S105 PolarHBondContact O-N 3.31Å; N103-S105 PolarHBondContact OD1-N 3.2Å; N103-S105 PolarHBondContact OD1-OG 3.25Å; N103-K106 HydrophobicContact CB-CB 4.3Å; N103-K106 PolarHBondContact OD1-N 2.86Å; N103-T109 HydrophobicContact CB-CG2 4.03Å; N103-T109 VanDerWaalsContact CB-O 3.26Å; N103-T109 WeakPolarHBondContact CB-O 3.46Å; N103-T109 PolarHBondContact N-O 2.87Å; N103-V111 HydrophobicContact CB-CG1 4.19Å
104	V	93.7	Very high	97.1	Very high	153 Å²	153	51.5 Å²	51.5	93%	0.927	28%	0.279	S	S	*	.	S	Bend	trans	-66.9	-27.4	-177.8	-63	0	0	0	0	113.8	K102	K102-V104 PolarHBondContact O-N 2.82Å
105	S	94.9	Very high	97.1	Very high	97 Å²	97	51.7 Å²	51.7	68%	0.678	28%	0.28	S	S	*	.	S	Bend	trans	-104.9	-31.1	-172.1	67.9	0	0	0	0	113.4	N103	N103-S105 VanDerWaalsContact C-N 3.28Å; N103-S105 PolarHBondContact O-N 3.31Å; N103-S105 PolarHBondContact OD1-N 3.2Å; N103-S105 PolarHBondContact OD1-OG 3.25Å
106	K	95.6	Very high	97.1	Very high	94 Å²	94	52 Å²	52	41%	0.409	28%	0.282	S	S	.	.	S	Bend	trans	-109.3	114.1	-177.7	-64.7	175.8	-179	169.2	0	110.1	N103 T109 E140	N103-K106 HydrophobicContact CB-CB 4.3Å; N103-K106 PolarHBondContact OD1-N 2.86Å; K106-T109 HydrophobicContact CB-CG2 4.27Å; K106-T109 WeakPolarHBondContact CB-OG1 3.15Å; K106-T109 HydrophobicContact CD-CG2 4.31Å; K106-T109 WeakPolarHBondContact O-CB 3.21Å; K106-T109 PolarHBondContact O-N 3.47Å; K106-E140 IonicContact NZ-OE1 2.73Å; K106-E140 PolarHBondContact NZ-OE1 2.82Å; K106-E140 IonicContact NZ-OE2 2.81Å; K106-E140 PolarHBondContact NZ-OE2 2.89Å
107	S	95.5	Very high	97.1	Very high	101 Å²	101	52 Å²	52	71%	0.706	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	147.9	173.5	-173.3	0	0	0	0	111.2	T109	S107-T109 PolarHBondContact O-N 3.23Å; S107-T109 VanDerWaalsContact O-N 3.14Å; S107-T109 PolarHBondContact O-OG1 3.34Å
108	Q	96	Very high	97.1	Very high	111 Å²	111	54.3 Å²	54.3	52%	0.519	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.4	33.3	180	-52.4	-57.6	-58.7	0	0	113.4	W110 S142	Q108-W110 HydrophobicContact CB-CH2 4.34Å; Q108-W110 HydrophobicContact CB-CZ3 4.31Å; Q108-W110 VanDerWaalsContact O-CZ3 3.26Å; Q108-W110 WeakPolarHBondContact O-CZ3 3.32Å; Q108-S142 WeakPolarHBondContact O-CA 3.49Å; Q108-S142 WeakPolarHBondContact O-CB 3.4Å
109	T	98.2	Very high	97.3	Very high	21 Å²	21	52.2 Å²	52.2	13%	0.129	28%	0.282	C	S	.	.			trans	-127.4	133.9	176.5	-54.1	0	0	0	0	108.1	N103 K106 S107 E140 G141	N103-T109 HydrophobicContact CB-CG2 4.03Å; N103-T109 VanDerWaalsContact CB-O 3.26Å; N103-T109 WeakPolarHBondContact CB-O 3.46Å; N103-T109 PolarHBondContact N-O 2.87Å; K106-T109 HydrophobicContact CB-CG2 4.27Å; K106-T109 WeakPolarHBondContact CB-OG1 3.15Å; K106-T109 HydrophobicContact CD-CG2 4.31Å; K106-T109 WeakPolarHBondContact O-CB 3.21Å; K106-T109 PolarHBondContact O-N 3.47Å; S107-T109 PolarHBondContact O-N 3.23Å; S107-T109 VanDerWaalsContact O-N 3.14Å; S107-T109 PolarHBondContact O-OG1 3.34Å; T109-E140 HydrophobicContact CG2-CB 4.21Å; T109-E140 HydrophobicContact CG2-CG 4.39Å; T109-G141 WeakPolarHBondContact CA-O 3.39Å
110	W	98.6	Very high	97.4	Very high	2 Å²	2	51.1 Å²	51.1	1%	0.008	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	157.8	173.6	-61.6	-102.1	0	0	0	109.3	S101 Q108 E140 G141 S144 G147 A149 M150	S101-W110 CarbonylContact O-C 3.36Å; S101-W110 WeakPolarHBondContact O-CA 3.39Å; Q108-W110 HydrophobicContact CB-CH2 4.34Å; Q108-W110 HydrophobicContact CB-CZ3 4.31Å; Q108-W110 VanDerWaalsContact O-CZ3 3.26Å; Q108-W110 WeakPolarHBondContact O-CZ3 3.32Å; W110-E140 WeakPolarHBondContact O-CA 3.4Å; W110-G141 PolarHBondContact N-O 3.12Å; W110-G141 PolarHBondContact O-N 2.97Å; W110-S144 WeakPolarHBondContact CH2-OG 3.16Å; W110-S144 VanDerWaalsContact CZ3-CB 3.48Å; W110-G147 WeakPolarHBondContact CZ2-O 3.32Å; W110-G147 PolarHBondContact NE1-O 2.77Å; W110-A149 HydrophobicContact CB-CB 3.93Å; W110-A149 VanDerWaalsContact CB-O 3.3Å; W110-A149 WeakPolarHBondContact CB-O 3.33Å; W110-A149 HydrophobicContact CD2-CB 3.82Å; W110-A149 HydrophobicContact CE3-CB 4.03Å; W110-A149 HydrophobicContact CG-CB 3.76Å; W110-M150 HydrophobicContact CB-CB 3.91Å; W110-M150 HydrophobicContact CB-CG 3.84Å
111	V	98.4	Very high	97.4	Very high	17 Å²	17	44.6 Å²	44.6	10%	0.103	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	149.1	-172	-54.6	0	0	0	0	111.8	L97 S101 N103 V138 L139 E140	L97-V111 HydrophobicContact CD1-CG2 4.18Å; S101-V111 WeakPolarHBondContact O-CG2 3.49Å; S101-V111 PolarHBondContact O-N 2.85Å; N103-V111 HydrophobicContact CB-CG1 4.19Å; V111-V138 HydrophobicContact CB-CG1 3.77Å; V111-V138 HydrophobicContact CG1-CG1 3.91Å; V111-L139 CarbonylContact C-O 3.59Å; V111-L139 WeakPolarHBondContact CA-O 3.32Å; V111-E140 HydrophobicContact CG1-CG 4.21Å
112	S	98.5	Very high	97.4	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	149.1	165.5	-179.6	0	0	0	0	109.2	I94 S95 L139 M150	I94-S112 WeakPolarHBondContact CG1-OG 3.47Å; S95-S112 PolarHBondContact N-OG 2.79Å; S95-S112 PolarHBondContact O-OG 2.98Å; S95-S112 PolarHBondContact OG-OG 3.08Å; S112-L139 PolarHBondContact N-O 3.33Å; S112-L139 PolarHBondContact O-N 3.01Å; S112-M150 WeakPolarHBondContact CB-O 3.43Å
113	I	98.4	Very high	97.1	Very high	9 Å²	9	44.1 Å²	44.1	5%	0.046	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	128.4	178.5	-52.7	-52.7	0	0	0	108.9	I94 S95 L97 Y136 V138 F380 F382	I94-I113 WeakPolarHBondContact CA-O 3Å; S95-I113 PolarHBondContact N-O 2.83Å; S95-I113 WeakPolarHBondContact OG-CB 3.37Å; S95-I113 PolarHBondContact OG-N 3.14Å; L97-I113 HydrophobicContact CD1-CG1 4.16Å; L97-I113 HydrophobicContact CD2-CG1 4.41Å; I113-Y136 HydrophobicContact CD1-CD2 4.15Å; I113-Y136 HydrophobicContact CD1-CE2 3.87Å; I113-Y136 HydrophobicContact CG2-CD1 4.23Å; I113-Y136 HydrophobicContact CG2-CD2 3.69Å; I113-Y136 HydrophobicContact CG2-CE2 4.31Å; I113-Y136 HydrophobicContact CG2-CG 3.65Å; I113-V138 HydrophobicContact CD1-CG2 4.23Å; I113-F380 HydrophobicContact CB-CD2 4.44Å; I113-F380 HydrophobicContact CD1-CZ 4.32Å; I113-F380 HydrophobicContact CG1-CD1 4.17Å; I113-F380 HydrophobicContact CG1-CD2 4.11Å; I113-F380 HydrophobicContact CG1-CE1 4.14Å; I113-F380 HydrophobicContact CG1-CE2 4.07Å; I113-F380 HydrophobicContact CG1-CG 4.15Å; I113-F380 HydrophobicContact CG1-CZ 4.09Å; I113-F380 HydrophobicContact CG2-CD2 4.08Å; I113-F380 HydrophobicContact CG2-CE2 4.11Å; I113-F382 HydrophobicContact CB-CE1 4.25Å; I113-F382 HydrophobicContact CB-CZ 4.46Å; I113-F382 HydrophobicContact CG2-CE1 4.11Å; I113-F382 HydrophobicContact CG2-CZ 4.01Å
114	F	98.4	Very high	97	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	99.9	174.3	-174.3	-79.4	0	0	0	107.9	V92 I94 T116 Y136 S137 L139 L162 I175 E178	V92-F114 HydrophobicContact CB-CE1 4.3Å; V92-F114 HydrophobicContact CB-CZ 4.06Å; V92-F114 HydrophobicContact CG2-CD1 3.93Å; V92-F114 HydrophobicContact CG2-CD2 3.78Å; V92-F114 HydrophobicContact CG2-CE1 3.54Å; V92-F114 HydrophobicContact CG2-CE2 3.41Å; V92-F114 VanDerWaalsContact CG2-CE2 3.41Å; V92-F114 HydrophobicContact CG2-CG 4.05Å; V92-F114 HydrophobicContact CG2-CZ 3.29Å; I94-F114 HydrophobicContact CD1-CD2 4.34Å; F114-T116 HydrophobicContact CD1-CG2 3.84Å; F114-T116 HydrophobicContact CE1-CG2 3.45Å; F114-T116 VanDerWaalsContact CE1-CG2 3.45Å; F114-T116 HydrophobicContact CZ-CG2 4.5Å; F114-Y136 WeakPolarHBondContact O-CA 3.45Å; F114-Y136 WeakPolarHBondContact O-CB 3.35Å; F114-S137 PolarHBondContact N-O 3.31Å; F114-S137 PolarHBondContact O-N 2.85Å; F114-L139 HydrophobicContact CB-CD1 4.22Å; F114-L139 HydrophobicContact CB-CG 4.19Å; F114-L139 HydrophobicContact CD2-CD1 4.1Å; F114-L162 HydrophobicContact CE2-CD2 3.83Å; F114-L162 HydrophobicContact CZ-CD2 3.99Å; F114-I175 HydrophobicContact CD2-CG2 4.13Å; F114-I175 HydrophobicContact CE2-CG2 3.74Å; F114-E178 HydrophobicContact CD1-CB 4.12Å; F114-E178 HydrophobicContact CE1-CB 3.51Å; F114-E178 HydrophobicContact CE1-CG 3.67Å; F114-E178 HydrophobicContact CZ-CB 3.82Å; F114-E178 HydrophobicContact CZ-CG 3.73Å
115	Q	98.5	Very high	96.9	Very high	4 Å²	4	43.2 Å²	43.2	2%	0.019	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	138.1	-177.9	173.7	69.7	56.1	0	0	109.5	V92 V93 W132 D133 F382	V92-Q115 CarbonylContact C-O 3.45Å; V92-Q115 WeakPolarHBondContact CA-O 3.18Å; V93-Q115 HydrophobicContact CG2-CB 3.85Å; V93-Q115 HydrophobicContact CG2-CG 4.25Å; V93-Q115 PolarHBondContact N-O 2.81Å; V93-Q115 PolarHBondContact O-N 2.95Å; Q115-W132 HydrophobicContact CG-CE3 3.79Å; Q115-W132 HydrophobicContact CG-CZ3 4.19Å; Q115-D133 PolarHBondContact NE2-O 3.49Å; Q115-F382 HydrophobicContact CB-CE1 3.94Å; Q115-F382 HydrophobicContact CB-CZ 3.77Å; Q115-F382 HydrophobicContact CG-CZ 4.49Å
116	T	98.4	Very high	97	Very high	7 Å²	7	41 Å²	41	4%	0.043	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	156.1	-177.5	56.8	0	0	0	0	111.2	R90 I91 V92 F114 D133	R90-T116 PolarHBondContact NH2-OG1 3.44Å; I91-T116 CarbonylContact O-C 3.54Å; I91-T116 VanDerWaalsContact O-CA 3.31Å; I91-T116 WeakPolarHBondContact O-CA 3.15Å; V92-T116 HydrophobicContact CB-CG2 4.25Å; V92-T116 HydrophobicContact CG2-CG2 4.34Å; F114-T116 HydrophobicContact CD1-CG2 3.84Å; F114-T116 HydrophobicContact CE1-CG2 3.45Å; F114-T116 VanDerWaalsContact CE1-CG2 3.45Å; F114-T116 HydrophobicContact CZ-CG2 4.5Å; T116-D133 WeakPolarHBondContact O-CB 3.44Å; T116-D133 PolarHBondContact O-N 2.9Å; T116-D133 PolarHBondContact OG1-OD2 2.89Å; T116-D133 VanDerWaalsContact OG1-OD2 3.14Å
117	G	98.4	Very high	97.1	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.5	-175.8	179	0	0	0	0	0	112.1	R90 I91 H131	R90-G117 WeakPolarHBondContact CD-O 3.29Å; R90-G117 VanDerWaalsContact NH1-C 3.29Å; R90-G117 VanDerWaalsContact NH1-CA 3.33Å; R90-G117 PolarHBondContact NH1-O 3.49Å; I91-G117 PolarHBondContact N-O 3.42Å; I91-G117 PolarHBondContact O-N 3.29Å; G117-H131 CarbonylContact C-O 3.47Å; G117-H131 WeakPolarHBondContact CA-O 3.41Å
118	I	98.4	Very high	97.2	Very high	71 Å²	71	35 Å²	35	36%	0.364	20%	0.199	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	118.6	176.3	-59.2	176	0	0	0	107.7	Y88 Y89 V130 H131	Y88-I118 HydrophobicContact CD1-CG2 3.84Å; Y88-I118 HydrophobicContact CG-CG2 4.46Å; Y89-I118 CarbonylContact O-C 3.57Å; Y89-I118 WeakPolarHBondContact O-CA 3.26Å; I118-V130 WeakPolarHBondContact O-CA 3.14Å; I118-H131 PolarHBondContact N-O 3.13Å; I118-H131 PolarHBondContact O-N 3.13Å
119	L	98.5	Very high	97.3	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88	130.5	167.6	171.8	66.7	0	0	0	108.8	Y88 Y89 I91 A128 I336 V345 V362	Y88-L119 CarbonylContact C-O 3.5Å; Y88-L119 WeakPolarHBondContact CA-O 3.45Å; Y89-L119 PolarHBondContact N-O 3Å; Y89-L119 PolarHBondContact O-N 3.38Å; I91-L119 HydrophobicContact CD1-CB 4.27Å; I91-L119 HydrophobicContact CG2-CB 3.89Å; L119-A128 HydrophobicContact CD1-CB 4.23Å; L119-I336 HydrophobicContact CD2-CD1 3.82Å; L119-I336 HydrophobicContact CD2-CG1 4.19Å; L119-V345 HydrophobicContact CD2-CB 4.07Å; L119-V345 HydrophobicContact CD2-CG1 4.42Å; L119-V345 HydrophobicContact CD2-CG2 4.14Å; L119-V362 HydrophobicContact CD1-CG2 3.75Å
120	R	97.6	Very high	97.3	Very high	101 Å²	101	31.6 Å²	31.6	38%	0.381	19%	0.185	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	131.5	175.3	179.8	-177.2	173.8	-127.3	4.9	110.4	N87 Y88 A128 D129	N87-R120 CarbonylContact O-C 3.57Å; N87-R120 VanDerWaalsContact O-CA 3.3Å; N87-R120 WeakPolarHBondContact O-CA 3.33Å; Y88-R120 HydrophobicContact CD1-CB 4Å; Y88-R120 HydrophobicContact CD1-CG 3.99Å; Y88-R120 HydrophobicContact CE1-CB 4.1Å; Y88-R120 HydrophobicContact CE1-CG 3.75Å; Y88-R120 HydrophobicContact CE2-CG 4.38Å; Y88-R120 HydrophobicContact CG-CG 4.44Å; Y88-R120 PolarHBondContact OH-NE 3.42Å; R120-A128 CarbonylContact O-C 3.11Å; R120-A128 WeakPolarHBondContact O-CA 3.45Å; R120-A128 WeakPolarHBondContact O-CB 3.49Å; R120-D129 WeakPolarHBondContact CB-OD2 3.47Å; R120-D129 VanDerWaalsContact CD-OD1 3.28Å; R120-D129 WeakPolarHBondContact CD-OD1 3.45Å; R120-D129 IonicContact CZ-OD1 3.28Å; R120-D129 PolarHBondContact N-O 3.03Å; R120-D129 IonicContact NE-OD1 3.1Å; R120-D129 IonicContact NH1-OD1 3.73Å; R120-D129 PolarHBondContact NH1-OD1 3.19Å; R120-D129 PolarHBondContact O-N 2.84Å
121	L	97.6	Very high	97.3	Very high	2 Å²	2	37.7 Å²	37.7	1%	0.01	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	145	167.2	-66.1	-174.8	0	0	0	110.9	N87 Y89 A128 I336 T339 L343 V362	N87-L121 HydrophobicContact CB-CB 4.15Å; N87-L121 WeakPolarHBondContact CB-O 3.42Å; N87-L121 PolarHBondContact O-N 2.78Å; Y89-L121 HydrophobicContact CE2-CB 4.48Å; Y89-L121 HydrophobicContact CE2-CD1 3.93Å; Y89-L121 HydrophobicContact CE2-CG 3.96Å; L121-A128 HydrophobicContact CD2-CB 3.59Å; L121-I336 HydrophobicContact CD1-CD1 4.29Å; L121-I336 HydrophobicContact CD1-CG2 3.84Å; L121-I336 HydrophobicContact CD2-CD1 4.06Å; L121-T339 HydrophobicContact CD1-CG2 4.2Å; L121-L343 HydrophobicContact CD1-CD1 3.95Å; L121-L343 HydrophobicContact CD2-CD1 4.5Å; L121-V362 HydrophobicContact CD2-CG1 4.4Å
122	S	96.3	Very high	97.3	Very high	20 Å²	20	38.9 Å²	38.9	14%	0.14	22%	0.215	C	C	.	.			trans	-65.3	155.9	166.1	67.7	0	0	0	0	110.8	D124 M125 S126 S127	S122-D124 VanDerWaalsContact CB-OD1 3.24Å; S122-D124 WeakPolarHBondContact CB-OD1 3.44Å; S122-D124 PolarHBondContact O-N 3.23Å; S122-D124 PolarHBondContact OG-OD1 2.86Å; S122-M125 PolarHBondContact O-N 2.58Å; S122-M125 PolarHBondContact OG-N 2.99Å; S122-S126 PolarHBondContact OG-N 3.47Å; S122-S127 WeakPolarHBondContact CB-OG 3.14Å; S122-S127 PolarHBondContact N-O 2.75Å; S122-S127 PolarHBondContact OG-N 2.87Å; S122-S127 PolarHBondContact OG-O 2.81Å; S122-S127 PolarHBondContact OG-OG 3.43Å
123	A	92.5	Very high	97.3	Very high	89 Å²	89	41.5 Å²	41.5	74%	0.736	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.3	-31.3	-177.7	0	0	0	0	0	113.8	N87 M125	N87-A123 WeakPolarHBondContact ND2-CA 3.37Å; A123-M125 VanDerWaalsContact C-N 3.33Å
124	D	93.4	Very high	97.2	Very high	113 Å²	113	49.6 Å²	49.6	60%	0.604	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.5	2	175.1	66.8	-18.5	0	0	0	113.2	S122 S126	S122-D124 VanDerWaalsContact CB-OD1 3.24Å; S122-D124 WeakPolarHBondContact CB-OD1 3.44Å; S122-D124 PolarHBondContact O-N 3.23Å; S122-D124 PolarHBondContact OG-OD1 2.86Å; D124-S126 PolarHBondContact O-N 3.17Å; D124-S126 VanDerWaalsContact O-N 3.16Å; D124-S126 PolarHBondContact OD1-N 3.24Å; D124-S126 PolarHBondContact OD1-OG 3.47Å; D124-S126 VanDerWaalsContact OD2-CB 3.25Å; D124-S126 WeakPolarHBondContact OD2-CB 3.41Å; D124-S126 PolarHBondContact OD2-OG 3.34Å
125	M	93.4	Very high	97.1	Very high	49 Å²	49	53 Å²	53	24%	0.241	30%	0.301	C	S	.	.	S	Bend	trans	54.4	31.1	-178.4	-55.2	178.5	-173	0	0	113.2	R85 S122 A123 L343 L370	R85-M125 VanDerWaalsContact NH2-CE 3.33Å; S122-M125 PolarHBondContact O-N 2.58Å; S122-M125 PolarHBondContact OG-N 2.99Å; A123-M125 VanDerWaalsContact C-N 3.33Å; M125-L343 HydrophobicContact CB-CD1 4.14Å; M125-L370 VanDerWaalsContact O-CD2 3.3Å; M125-L370 WeakPolarHBondContact O-CD2 3.38Å
126	S	95.1	Very high	97.1	Very high	51 Å²	51	58 Å²	58	36%	0.357	32%	0.321	S	S	.	.	S	Bend	trans	-95	-19.8	178.6	72.7	0	0	0	0	113.2	S122 D124	S122-S126 PolarHBondContact OG-N 3.47Å; D124-S126 PolarHBondContact O-N 3.17Å; D124-S126 VanDerWaalsContact O-N 3.16Å; D124-S126 PolarHBondContact OD1-N 3.24Å; D124-S126 PolarHBondContact OD1-OG 3.47Å; D124-S126 VanDerWaalsContact OD2-CB 3.25Å; D124-S126 WeakPolarHBondContact OD2-CB 3.41Å; D124-S126 PolarHBondContact OD2-OG 3.34Å
127	S	98	Very high	97	Very high	57 Å²	57	59.4 Å²	59.4	40%	0.399	33%	0.331	S	S	.	.			trans	-143.9	163.6	177.5	64.9	0	0	0	0	112	S122	S122-S127 WeakPolarHBondContact CB-OG 3.14Å; S122-S127 PolarHBondContact N-O 2.75Å; S122-S127 PolarHBondContact OG-N 2.87Å; S122-S127 PolarHBondContact OG-O 2.81Å; S122-S127 PolarHBondContact OG-OG 3.43Å
128	A	98.4	Very high	97	Very high	11 Å²	11	62.4 Å²	62.4	9%	0.091	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	153.9	175.3	0	0	0	0	0	111.1	L119 R120 L121 V362 L370 L371	L119-A128 HydrophobicContact CD1-CB 4.23Å; R120-A128 CarbonylContact O-C 3.11Å; R120-A128 WeakPolarHBondContact O-CA 3.45Å; R120-A128 WeakPolarHBondContact O-CB 3.49Å; L121-A128 HydrophobicContact CD2-CB 3.59Å; A128-V362 HydrophobicContact CB-CB 4.01Å; A128-V362 HydrophobicContact CB-CG1 4.09Å; A128-V362 HydrophobicContact CB-CG2 4Å; A128-L370 HydrophobicContact CB-CB 4.42Å; A128-L370 PolarHBondContact N-O 2.79Å; A128-L371 HydrophobicContact CB-CB 4.04Å
129	D	98.1	Very high	97	Very high	42 Å²	42	59 Å²	59	23%	0.225	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	156.1	171.1	65.3	-107.1	0	0	0	110.4	R120 H131	R120-D129 WeakPolarHBondContact CB-OD2 3.47Å; R120-D129 VanDerWaalsContact CD-OD1 3.28Å; R120-D129 WeakPolarHBondContact CD-OD1 3.45Å; R120-D129 IonicContact CZ-OD1 3.28Å; R120-D129 PolarHBondContact N-O 3.03Å; R120-D129 IonicContact NE-OD1 3.1Å; R120-D129 IonicContact NH1-OD1 3.73Å; R120-D129 PolarHBondContact NH1-OD1 3.19Å; R120-D129 PolarHBondContact O-N 2.84Å; D129-H131 IonicContact OD2-CD2 3.61Å; D129-H131 PolarHBondContact OD2-CD2 3.08Å; D129-H131 IonicContact OD2-NE2 2.65Å
130	V	98.5	Very high	96.9	Very high	18 Å²	18	63 Å²	63	11%	0.109	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	134.7	179.7	64.3	0	0	0	0	109.9	I91 I118 W132 L360 L371	I91-V130 HydrophobicContact CD1-CG2 3.92Å; I118-V130 WeakPolarHBondContact O-CA 3.14Å; V130-W132 HydrophobicContact CG2-CD2 4.4Å; V130-W132 HydrophobicContact CG2-CZ2 4.04Å; V130-L360 HydrophobicContact CB-CD2 4.13Å; V130-L360 HydrophobicContact CG1-CD2 4.13Å; V130-L360 HydrophobicContact CG2-CD2 4.3Å; V130-L371 HydrophobicContact CB-CD2 4.33Å; V130-L371 HydrophobicContact CG1-CD2 4Å
131	H	98.3	Very high	96.9	Very high	130 Å²	130	58.8 Å²	58.8	60%	0.602	34%	0.338	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-122.6	118.6	174.2	-71.3	-73.1	0	0	0	109.1	G117 I118 D129	G117-H131 CarbonylContact C-O 3.47Å; G117-H131 WeakPolarHBondContact CA-O 3.41Å; I118-H131 PolarHBondContact N-O 3.13Å; I118-H131 PolarHBondContact O-N 3.13Å; D129-H131 IonicContact OD2-CD2 3.61Å; D129-H131 PolarHBondContact OD2-CD2 3.08Å; D129-H131 IonicContact OD2-NE2 2.65Å
132	W	98.6	Very high	96.9	Very high	42 Å²	42	62.7 Å²	62.7	16%	0.159	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	146.8	178.1	-62.9	105.5	0	0	0	110.9	I91 V93 Q115 V130 L360 I375 I376 P377	I91-W132 HydrophobicContact CD1-CH2 3.71Å; I91-W132 HydrophobicContact CD1-CZ2 4.35Å; I91-W132 HydrophobicContact CD1-CZ3 4Å; I91-W132 HydrophobicContact CG1-CH2 4.49Å; I91-W132 HydrophobicContact CG1-CZ3 4.32Å; V93-W132 HydrophobicContact CG1-CH2 3.85Å; V93-W132 HydrophobicContact CG1-CZ3 4.34Å; V93-W132 HydrophobicContact CG2-CH2 3.95Å; V93-W132 HydrophobicContact CG2-CZ3 3.87Å; Q115-W132 HydrophobicContact CG-CE3 3.79Å; Q115-W132 HydrophobicContact CG-CZ3 4.19Å; V130-W132 HydrophobicContact CG2-CD2 4.4Å; V130-W132 HydrophobicContact CG2-CZ2 4.04Å; W132-L360 HydrophobicContact CH2-CD1 3.81Å; W132-L360 HydrophobicContact CZ2-CB 4.06Å; W132-L360 HydrophobicContact CZ2-CD1 3.75Å; W132-L360 HydrophobicContact CZ2-CG 4.49Å; W132-I375 PolarHBondContact NE1-O 2.86Å; W132-I376 HydrophobicContact CD2-CG2 4.39Å; W132-I376 HydrophobicContact CH2-CD1 4.25Å; W132-I376 HydrophobicContact CH2-CG1 4.36Å; W132-I376 HydrophobicContact CH2-CG2 4.17Å; W132-I376 HydrophobicContact CZ2-CB 4.23Å; W132-I376 HydrophobicContact CZ2-CD1 4.01Å; W132-I376 HydrophobicContact CZ2-CG1 3.67Å; W132-I376 HydrophobicContact CZ2-CG2 3.9Å; W132-P377 HydrophobicContact CB-CG 3.79Å; W132-P377 VanDerWaalsContact CG-CD 3.45Å; W132-P377 HydrophobicContact CG-CG 3.87Å
133	D	98.3	Very high	96.9	Very high	55 Å²	55	65.2 Å²	65.2	29%	0.294	38%	0.376	S	S	.	.			trans	-69.5	146.8	172.7	-67.7	20.9	0	0	0	110.3	R90 Q115 T116 A135	R90-D133 IonicContact CZ-OD1 2.59Å; R90-D133 IonicContact CZ-OD2 2.64Å; R90-D133 VanDerWaalsContact CZ-OD2 3.28Å; R90-D133 IonicContact NH1-OD1 3.83Å; R90-D133 PolarHBondContact NH1-OD1 2.94Å; R90-D133 IonicContact NH1-OD2 3.79Å; R90-D133 PolarHBondContact NH1-OD2 3.36Å; R90-D133 VanDerWaalsContact NH1-OD2 3.1Å; R90-D133 IonicContact NH2-OD1 2.67Å; R90-D133 IonicContact NH2-OD2 3.85Å; R90-D133 PolarHBondContact NH2-OD2 3.2Å; Q115-D133 PolarHBondContact NE2-O 3.49Å; T116-D133 WeakPolarHBondContact O-CB 3.44Å; T116-D133 PolarHBondContact O-N 2.9Å; T116-D133 PolarHBondContact OG1-OD2 2.89Å; T116-D133 VanDerWaalsContact OG1-OD2 3.14Å; D133-A135 PolarHBondContact O-N 3Å
134	D	96.7	Very high	97.1	Very high	179 Å²	179	63 Å²	63	96%	0.957	36%	0.355	S	S	*	.	S	Bend	trans	-63.3	-23.5	-178.4	-68.2	-34.2	0	0	0	113.4
135	A	96	Very high	97.3	Very high	72 Å²	72	60 Å²	60	60%	0.595	34%	0.338	S	S	*	.			trans	-123.2	141.7	-177.3	0	0	0	0	0	111.6	D133	D133-A135 PolarHBondContact O-N 3Å
136	Y	97.6	Very high	97.4	Very high	110 Å²	110	66.9 Å²	66.9	43%	0.431	37%	0.366	S	S	.	.			trans	-104.5	159	165.9	54.5	-99.2	0	0	0	111.1	I113 F114 V138 F380	I113-Y136 HydrophobicContact CD1-CD2 4.15Å; I113-Y136 HydrophobicContact CD1-CE2 3.87Å; I113-Y136 HydrophobicContact CG2-CD1 4.23Å; I113-Y136 HydrophobicContact CG2-CD2 3.69Å; I113-Y136 HydrophobicContact CG2-CE2 4.31Å; I113-Y136 HydrophobicContact CG2-CG 3.65Å; F114-Y136 WeakPolarHBondContact O-CA 3.45Å; F114-Y136 WeakPolarHBondContact O-CB 3.35Å; Y136-V138 HydrophobicContact CD2-CG2 4.01Å; Y136-V138 HydrophobicContact CE2-CG2 3.8Å; Y136-F380 HydrophobicContact CD1-CE2 4.42Å; Y136-F380 AromaticContact CE1-CE2 3.95Å; Y136-F380 HydrophobicContact CE1-CE2 3.95Å; Y136-F380 HydrophobicContact CE1-CZ 4.37Å
137	S	97.7	Very high	97.5	Very high	36 Å²	36	66.1 Å²	66.1	25%	0.252	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	152.9	167.4	-69.6	0	0	0	0	110.6	F114 E178	F114-S137 PolarHBondContact N-O 3.31Å; F114-S137 PolarHBondContact O-N 2.85Å; S137-E178 WeakPolarHBondContact CB-O 3.3Å; S137-E178 PolarHBondContact OG-O 3.37Å
138	V	97.9	Very high	97.5	Very high	63 Å²	63	65.1 Å²	65.1	38%	0.382	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	121	174.1	-179.8	0	0	0	0	108.4	V111 I113 Y136 E140	V111-V138 HydrophobicContact CB-CG1 3.77Å; V111-V138 HydrophobicContact CG1-CG1 3.91Å; I113-V138 HydrophobicContact CD1-CG2 4.23Å; Y136-V138 HydrophobicContact CD2-CG2 4.01Å; Y136-V138 HydrophobicContact CE2-CG2 3.8Å; V138-E140 HydrophobicContact CG1-CG 4.49Å
139	L	98.4	Very high	97.5	Very high	0 Å²	0	64.6 Å²	64.6	0%	0	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	126.6	173	-59	173.4	0	0	0	108.4	I94 V111 S112 F114 M150 L152 I175 T179 A181	I94-L139 HydrophobicContact CD1-CD1 3.62Å; I94-L139 HydrophobicContact CG1-CD1 4.37Å; V111-L139 CarbonylContact C-O 3.59Å; V111-L139 WeakPolarHBondContact CA-O 3.32Å; S112-L139 PolarHBondContact N-O 3.33Å; S112-L139 PolarHBondContact O-N 3.01Å; F114-L139 HydrophobicContact CB-CD1 4.22Å; F114-L139 HydrophobicContact CB-CG 4.19Å; F114-L139 HydrophobicContact CD2-CD1 4.1Å; L139-M150 HydrophobicContact CB-CE 3.7Å; L139-L152 HydrophobicContact CD1-CD1 4.24Å; L139-I175 HydrophobicContact CD1-CD1 3.84Å; L139-I175 HydrophobicContact CD1-CG2 4.34Å; L139-I175 HydrophobicContact CD2-CG2 4.1Å; L139-T179 VanDerWaalsContact CD2-C 3.41Å; L139-A181 HydrophobicContact CB-CB 4.42Å
140	E	97.6	Very high	97.5	Very high	84 Å²	84	62.6 Å²	62.6	39%	0.393	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	141.7	176.7	-60.3	-167.5	157	0	0	111.2	K106 T109 W110 V111 V138	K106-E140 IonicContact NZ-OE1 2.73Å; K106-E140 PolarHBondContact NZ-OE1 2.82Å; K106-E140 IonicContact NZ-OE2 2.81Å; K106-E140 PolarHBondContact NZ-OE2 2.89Å; T109-E140 HydrophobicContact CG2-CB 4.21Å; T109-E140 HydrophobicContact CG2-CG 4.39Å; W110-E140 WeakPolarHBondContact O-CA 3.4Å; V111-E140 HydrophobicContact CG1-CG 4.21Å; V138-E140 HydrophobicContact CG1-CG 4.49Å
141	G	97	Very high	97.5	Very high	12 Å²	12	61.8 Å²	61.8	12%	0.124	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	153.7	172.7	0	0	0	0	0	111.7	T109 W110	T109-G141 WeakPolarHBondContact CA-O 3.39Å; W110-G141 PolarHBondContact N-O 3.12Å; W110-G141 PolarHBondContact O-N 2.97Å
142	S	96.7	Very high	97.5	Very high	84 Å²	84	55.6 Å²	55.6	59%	0.587	31%	0.306	S	S	*	.			trans	-125.7	-7.2	-179.1	60.5	0	0	0	0	114.1	Q108 S144	Q108-S142 WeakPolarHBondContact O-CA 3.49Å; Q108-S142 WeakPolarHBondContact O-CB 3.4Å; S142-S144 PolarHBondContact O-N 3.41Å
143	I	97.2	Very high	97.5	Very high	72 Å²	72	53.6 Å²	53.6	37%	0.369	30%	0.298	S	S	.	.			trans	-85	113.9	175.4	-54.6	175.8	0	0	0	107.3	A149 F171 P183	I143-A149 WeakPolarHBondContact O-CB 3.26Å; I143-F171 HydrophobicContact CB-CE2 4.5Å; I143-F171 HydrophobicContact CG2-CD2 4.03Å; I143-F171 HydrophobicContact CG2-CE2 3.45Å; I143-F171 VanDerWaalsContact CG2-CE2 3.45Å; I143-F171 HydrophobicContact CG2-CZ 4.21Å; I143-P183 HydrophobicContact CD1-CB 4.38Å; I143-P183 HydrophobicContact CD1-CG 3.71Å
144	S	97.3	Very high	97.5	Very high	42 Å²	42	51 Å²	51	29%	0.294	28%	0.284	S	S	.	.			trans	-126.9	158.5	-178.1	68.6	0	0	0	0	113.2	W110 S142 R148	W110-S144 WeakPolarHBondContact CH2-OG 3.16Å; W110-S144 VanDerWaalsContact CZ3-CB 3.48Å; S142-S144 PolarHBondContact O-N 3.41Å; S144-R148 WeakPolarHBondContact CA-O 3.46Å; S144-R148 VanDerWaalsContact CB-O 3.31Å; S144-R148 WeakPolarHBondContact CB-O 3.45Å
145	Q	96.9	Very high	97.6	Very high	51 Å²	51	42.5 Å²	42.5	24%	0.238	24%	0.239	C	C	.	.	B	Isolated β-bridge	trans	-120.3	120.1	170.2	-178.9	160.1	91.4	0	0	108.8	G147 R148 R168 T169	Q145-G147 PolarHBondContact O-N 2.92Å; Q145-G147 VanDerWaalsContact O-N 3.17Å; Q145-R148 PolarHBondContact N-O 3.43Å; Q145-R148 PolarHBondContact O-N 3.29Å; Q145-R168 WeakPolarHBondContact CB-O 3.45Å; Q145-R168 PolarHBondContact OE1-O 2.9Å; Q145-T169 HydrophobicContact CB-CG2 4.27Å
146	K	95.7	Very high	97.7	Very high	193 Å²	193	40.1 Å²	40.1	84%	0.839	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.3	33.6	-176.7	-57.6	178.4	179.3	176	0	113.4
147	G	96.2	Very high	97.7	Very high	36 Å²	36	38 Å²	38	37%	0.371	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	79.4	16.2	176	0	0	0	0	0	115.7	W110 Q145	W110-G147 WeakPolarHBondContact CZ2-O 3.32Å; W110-G147 PolarHBondContact NE1-O 2.77Å; Q145-G147 PolarHBondContact O-N 2.92Å; Q145-G147 VanDerWaalsContact O-N 3.17Å
148	R	97.8	Very high	97.7	Very high	36 Å²	36	36.8 Å²	36.8	14%	0.136	20%	0.204	C	C	.	.	B	Isolated β-bridge	trans	-125.6	143.6	173.7	-74.8	177.6	70.3	169.9	-0.9	110.4	D98 H99 S144 Q145 E151 R168	D98-R148 IonicContact OD1-NH2 2.58Å; D98-R148 PolarHBondContact OD1-NH2 2.87Å; H99-R148 PolarHBondContact NE2-NH1 2.89Å; S144-R148 WeakPolarHBondContact CA-O 3.46Å; S144-R148 VanDerWaalsContact CB-O 3.31Å; S144-R148 WeakPolarHBondContact CB-O 3.45Å; Q145-R148 PolarHBondContact N-O 3.43Å; Q145-R148 PolarHBondContact O-N 3.29Å; R148-E151 WeakPolarHBondContact CB-OE1 3.31Å; R148-E151 WeakPolarHBondContact CG-OE1 3.38Å; R148-E151 IonicContact CZ-OE1 2.78Å; R148-E151 IonicContact CZ-OE2 2.66Å; R148-E151 VanDerWaalsContact CZ-OE2 3.25Å; R148-E151 IonicContact NE-OE1 3.6Å; R148-E151 PolarHBondContact NE-OE1 2.88Å; R148-E151 IonicContact NE-OE2 2.94Å; R148-E151 PolarHBondContact NE-OE2 3.34Å; R148-E151 IonicContact NH2-OE1 3.48Å; R148-E151 IonicContact NH2-OE2 3.87Å; R148-E151 PolarHBondContact NH2-OE2 2.9Å; R148-R168 HydrophobicContact CB-CB 4.11Å; R148-R168 HydrophobicContact CB-CG 3.95Å
149	A	98.3	Very high	97.6	Very high	0 Å²	0	38 Å²	38	0%	0	21%	0.208	C	C	.	.			trans	-170.1	170	179.4	0	0	0	0	0	110.3	S101 W110 I143 E151 D166 T169	S101-A149 WeakPolarHBondContact CB-O 3.31Å; S101-A149 PolarHBondContact OG-O 2.91Å; W110-A149 HydrophobicContact CB-CB 3.93Å; W110-A149 VanDerWaalsContact CB-O 3.3Å; W110-A149 WeakPolarHBondContact CB-O 3.33Å; W110-A149 HydrophobicContact CD2-CB 3.82Å; W110-A149 HydrophobicContact CE3-CB 4.03Å; W110-A149 HydrophobicContact CG-CB 3.76Å; I143-A149 WeakPolarHBondContact O-CB 3.26Å; A149-E151 PolarHBondContact O-N 2.86Å; A149-D166 WeakPolarHBondContact CA-OD2 3.35Å; A149-T169 HydrophobicContact CB-CG2 3.93Å
150	M	98.5	Very high	97.4	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	25%	0.247	C	C	.	.			trans	59.3	27.1	177.6	-57.8	-60.4	-64	0	0	113.4	W110 S112 L139 L152 D166 Y173 A181	W110-M150 HydrophobicContact CB-CB 3.91Å; W110-M150 HydrophobicContact CB-CG 3.84Å; S112-M150 WeakPolarHBondContact CB-O 3.43Å; L139-M150 HydrophobicContact CB-CE 3.7Å; M150-L152 HydrophobicContact CE-CD1 3.97Å; M150-L152 PolarHBondContact O-N 2.58Å; M150-D166 PolarHBondContact N-OD2 2.84Å; M150-Y173 HydrophobicContact SD-CE1 4.44Å; M150-Y173 HydrophobicContact SD-CE2 4.39Å; M150-A181 HydrophobicContact CE-CB 3.95Å
151	E	98.5	Very high	97.4	Very high	0 Å²	0	42 Å²	42	0%	0	24%	0.244	C	C	.	.			trans	-94	88.7	170.4	-69.3	175.6	-140.6	0	0	106	D96 D98 R148 A149 D166 D167 R168	D96-E151 WeakPolarHBondContact OD1-CB 3.38Å; D98-E151 WeakPolarHBondContact O-CG 3.46Å; R148-E151 WeakPolarHBondContact CB-OE1 3.31Å; R148-E151 WeakPolarHBondContact CG-OE1 3.38Å; R148-E151 IonicContact CZ-OE1 2.78Å; R148-E151 IonicContact CZ-OE2 2.66Å; R148-E151 VanDerWaalsContact CZ-OE2 3.25Å; R148-E151 IonicContact NE-OE1 3.6Å; R148-E151 PolarHBondContact NE-OE1 2.88Å; R148-E151 IonicContact NE-OE2 2.94Å; R148-E151 PolarHBondContact NE-OE2 3.34Å; R148-E151 IonicContact NH2-OE1 3.48Å; R148-E151 IonicContact NH2-OE2 3.87Å; R148-E151 PolarHBondContact NH2-OE2 2.9Å; A149-E151 PolarHBondContact O-N 2.86Å; E151-D166 WeakPolarHBondContact O-CA 3.48Å; E151-D167 PolarHBondContact O-N 3.45Å; E151-D167 VanDerWaalsContact O-N 3.17Å; E151-R168 HydrophobicContact CB-CG 3.84Å; E151-R168 HydrophobicContact CG-CG 4.06Å; E151-R168 WeakPolarHBondContact OE2-CD 3.41Å; E151-R168 WeakPolarHBondContact OE2-CG 3.49Å
152	L	98.7	Very high	97.5	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	109.8	-162.2	-66.6	-173.3	0	0	0	111	I94 S95 L139 M150 S164 V165 D166 Y173	I94-L152 HydrophobicContact CD1-CB 4.2Å; I94-L152 HydrophobicContact CD1-CD1 3.34Å; I94-L152 HydrophobicContact CD1-CG 4.4Å; I94-L152 HydrophobicContact CG1-CB 4.05Å; I94-L152 HydrophobicContact CG1-CD1 3.83Å; I94-L152 HydrophobicContact CG2-CB 4.14Å; S95-L152 CarbonylContact C-O 2.94Å; S95-L152 PolarHBondContact O-N 3.01Å; L139-L152 HydrophobicContact CD1-CD1 4.24Å; M150-L152 HydrophobicContact CE-CD1 3.97Å; M150-L152 PolarHBondContact O-N 2.58Å; L152-S164 WeakPolarHBondContact CB-OG 3.39Å; L152-V165 WeakPolarHBondContact CA-O 3.34Å; L152-D166 HydrophobicContact CD2-CB 3.8Å; L152-Y173 HydrophobicContact CD2-CD2 4.12Å; L152-Y173 HydrophobicContact CD2-CE2 4.46Å
153	S	98.2	Very high	97.6	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	-18.1	-164.6	-43.2	0	0	0	0	115.2	V165 D167 A200 E383	S153-V165 PolarHBondContact N-O 2.88Å; S153-V165 VanDerWaalsContact N-O 3.07Å; S153-D167 WeakPolarHBondContact OG-CB 3.4Å; S153-D167 PolarHBondContact OG-OD2 2.96Å; S153-A200 WeakPolarHBondContact CB-O 3.5Å; S153-A200 PolarHBondContact OG-O 3.2Å; S153-E383 CarbonylContact O-C 3.44Å; S153-E383 WeakPolarHBondContact O-CB 3.33Å
154	D	98.4	Very high	97.6	Very high	1 Å²	1	35.1 Å²	35.1	1%	0.005	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.4	170.3	174.7	-156.7	0.1	0	0	0	112.8	S164 M203	D154-S164 WeakPolarHBondContact O-CA 3.45Å; D154-S164 WeakPolarHBondContact O-CB 3.37Å; D154-S164 PolarHBondContact O-OG 3.48Å; D154-M203 HydrophobicContact CB-CB 4.38Å; D154-M203 HydrophobicContact CB-CE 3.75Å; D154-M203 HydrophobicContact CB-CG 4.28Å; D154-M203 WeakPolarHBondContact O-CE 3.31Å; D154-M203 PolarHBondContact OD2-N 3.15Å
155	L	98.3	Very high	97.7	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	137.5	170.9	-79.4	171.8	0	0	0	111.6	V92 I94 L162 L163 Q334 E386	V92-L155 HydrophobicContact CB-CD1 4.36Å; V92-L155 HydrophobicContact CG1-CD1 3.85Å; V92-L155 HydrophobicContact CG2-CD1 3.74Å; I94-L155 HydrophobicContact CB-CD1 3.78Å; I94-L155 HydrophobicContact CB-CD2 4.35Å; I94-L155 HydrophobicContact CB-CG 3.92Å; I94-L155 HydrophobicContact CD1-CD2 3.91Å; I94-L155 HydrophobicContact CD1-CG 4.4Å; I94-L155 HydrophobicContact CG2-CD1 3.98Å; I94-L155 HydrophobicContact CG2-CD2 4.27Å; I94-L155 HydrophobicContact CG2-CG 3.63Å; L155-L162 HydrophobicContact CB-CD1 4.48Å; L155-L162 HydrophobicContact CD2-CD1 4.02Å; L155-L162 HydrophobicContact CD2-CD2 4.49Å; L155-L162 HydrophobicContact CD2-CG 4.13Å; L155-L163 CarbonylContact C-O 3.43Å; L155-L163 WeakPolarHBondContact CA-O 3.1Å; L155-Q334 PolarHBondContact O-NE2 2.87Å; L155-E386 HydrophobicContact CB-CB 3.87Å
156	K	98.5	Very high	97.8	Very high	23 Å²	23	30.7 Å²	30.7	10%	0.1	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150	131.6	174.7	-161.4	71.1	-165.9	175	0	113.8	F158 L163 M203 V205 L210 E386	K156-F158 PolarHBondContact O-N 2.84Å; K156-L163 PolarHBondContact N-O 2.78Å; K156-L163 WeakPolarHBondContact O-CB 3.39Å; K156-L163 PolarHBondContact O-N 2.55Å; K156-M203 HydrophobicContact CB-CB 3.9Å; K156-M203 HydrophobicContact CB-CE 4.1Å; K156-M203 HydrophobicContact CB-SD 4.38Å; K156-M203 HydrophobicContact CG-CB 4.46Å; K156-V205 HydrophobicContact CD-CG2 4.48Å; K156-V205 HydrophobicContact CG-CG2 3.88Å; K156-L210 HydrophobicContact CB-CD1 4.26Å; K156-L210 HydrophobicContact CG-CD1 4.06Å; K156-E386 WeakPolarHBondContact CA-OE2 3.18Å
157	V	98.1	Very high	97.9	Very high	65 Å²	65	21.7 Å²	21.7	39%	0.394	13%	0.134	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	119.2	164.1	175.9	0	0	0	0	110	R161 L162 E386	V157-R161 CarbonylContact C-O 3.53Å; V157-R161 VanDerWaalsContact CA-O 3.28Å; V157-R161 WeakPolarHBondContact CA-O 3.08Å; V157-L162 HydrophobicContact CG2-CD1 4.09Å; V157-E386 HydrophobicContact CG2-CG 3.83Å; V157-E386 PolarHBondContact N-OE2 3.35Å
158	F	97.8	Very high	98	Very high	11 Å²	11	23.1 Å²	23.1	5%	0.048	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	132.7	174.8	176.8	-109.9	0	0	0	110.7	K156 G160 R161 L163 W184 V205 D208 L210	K156-F158 PolarHBondContact O-N 2.84Å; F158-G160 PolarHBondContact O-N 2.61Å; F158-R161 PolarHBondContact N-O 2.8Å; F158-R161 WeakPolarHBondContact O-CB 3.37Å; F158-R161 PolarHBondContact O-N 3.08Å; F158-L163 HydrophobicContact CB-CD1 3.89Å; F158-L163 HydrophobicContact CD1-CD1 4.06Å; F158-L163 HydrophobicContact CG-CD1 4.47Å; F158-W184 HydrophobicContact CD1-CH2 4.29Å; F158-W184 HydrophobicContact CD1-CZ3 4.41Å; F158-W184 HydrophobicContact CE1-CH2 4.16Å; F158-V205 HydrophobicContact CB-CG2 4.19Å; F158-V205 HydrophobicContact CD2-CG1 4.15Å; F158-V205 HydrophobicContact CD2-CG2 3.78Å; F158-V205 HydrophobicContact CE2-CG1 4.47Å; F158-V205 HydrophobicContact CG-CG2 4.4Å; F158-D208 WeakPolarHBondContact CE2-O 3.34Å; F158-L210 HydrophobicContact CB-CD1 4.27Å; F158-L210 HydrophobicContact CD1-CB 3.9Å; F158-L210 HydrophobicContact CD1-CD2 4.32Å; F158-L210 HydrophobicContact CD2-CB 4.11Å; F158-L210 HydrophobicContact CE1-CB 4Å; F158-L210 HydrophobicContact CE2-CB 4.22Å; F158-L210 HydrophobicContact CG-CB 3.94Å; F158-L210 HydrophobicContact CG-CD1 4.46Å; F158-L210 HydrophobicContact CZ-CB 4.16Å
159	N	95.1	Very high	98	Very high	88 Å²	88	21.6 Å²	21.6	47%	0.471	12%	0.123	S	C	.	.	T	Hydrogen-bonded Turn	trans	51	42	179.2	-163.6	24.5	0	0	0	113.4	R161 N239	N159-R161 VanDerWaalsContact C-N 3.28Å; N159-R161 PolarHBondContact O-N 3.35Å; N159-N239 PolarHBondContact ND2-O 2.91Å
160	G	95.4	Very high	98	Very high	79 Å²	79	21.6 Å²	21.6	81%	0.814	12%	0.123	S	C	*	.	T	Hydrogen-bonded Turn	trans	72.1	13.9	179.8	0	0	0	0	0	115.3	F158	F158-G160 PolarHBondContact O-N 2.61Å
161	R	97.1	Very high	98	Very high	90 Å²	90	23.7 Å²	23.7	34%	0.34	13%	0.132	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	140.7	179.9	-62.8	176.2	-171.2	172.4	1.7	110.1	V157 F158 N159 L163 N174 W184	V157-R161 CarbonylContact C-O 3.53Å; V157-R161 VanDerWaalsContact CA-O 3.28Å; V157-R161 WeakPolarHBondContact CA-O 3.08Å; F158-R161 PolarHBondContact N-O 2.8Å; F158-R161 WeakPolarHBondContact O-CB 3.37Å; F158-R161 PolarHBondContact O-N 3.08Å; N159-R161 VanDerWaalsContact C-N 3.28Å; N159-R161 PolarHBondContact O-N 3.35Å; R161-L163 HydrophobicContact CB-CD2 3.71Å; R161-L163 HydrophobicContact CB-CG 4.18Å; R161-N174 WeakPolarHBondContact CB-OD1 3.3Å; R161-W184 VanDerWaalsContact NH1-CE2 3.34Å
162	L	98.4	Very high	98	Very high	22 Å²	22	23.7 Å²	23.7	12%	0.115	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	113.2	166.7	-180	61.6	0	0	0	107.9	F114 L155 V157 N174 I175 E386 I388	F114-L162 HydrophobicContact CE2-CD2 3.83Å; F114-L162 HydrophobicContact CZ-CD2 3.99Å; L155-L162 HydrophobicContact CB-CD1 4.48Å; L155-L162 HydrophobicContact CD2-CD1 4.02Å; L155-L162 HydrophobicContact CD2-CD2 4.49Å; L155-L162 HydrophobicContact CD2-CG 4.13Å; V157-L162 HydrophobicContact CG2-CD1 4.09Å; L162-N174 PolarHBondContact O-OD1 2.79Å; L162-I175 HydrophobicContact CB-CB 4.44Å; L162-I175 HydrophobicContact CD2-CB 4.21Å; L162-I175 HydrophobicContact CD2-CG2 4.48Å; L162-I175 HydrophobicContact CG-CB 4.25Å; L162-I175 PolarHBondContact O-N 2.82Å; L162-E386 HydrophobicContact CD1-CB 4.06Å; L162-E386 HydrophobicContact CD1-CG 3.9Å; L162-I388 HydrophobicContact CD1-CG2 4.42Å; L162-I388 HydrophobicContact CD2-CG2 4.39Å
163	L	98.6	Very high	98	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	147.9	-175.7	-56.2	-179.4	0	0	0	110.8	L155 K156 F158 R161 I172 Y173 N174 W184 M203 L210	L155-L163 CarbonylContact C-O 3.43Å; L155-L163 WeakPolarHBondContact CA-O 3.1Å; K156-L163 PolarHBondContact N-O 2.78Å; K156-L163 WeakPolarHBondContact O-CB 3.39Å; K156-L163 PolarHBondContact O-N 2.55Å; F158-L163 HydrophobicContact CB-CD1 3.89Å; F158-L163 HydrophobicContact CD1-CD1 4.06Å; F158-L163 HydrophobicContact CG-CD1 4.47Å; R161-L163 HydrophobicContact CB-CD2 3.71Å; R161-L163 HydrophobicContact CB-CG 4.18Å; L163-I172 HydrophobicContact CB-CG2 4.03Å; L163-I172 HydrophobicContact CD1-CG2 4.17Å; L163-I172 HydrophobicContact CD2-CG2 4.33Å; L163-I172 HydrophobicContact CG-CG2 4.41Å; L163-Y173 CarbonylContact C-O 3.59Å; L163-Y173 VanDerWaalsContact CA-O 3.22Å; L163-Y173 WeakPolarHBondContact CA-O 3.3Å; L163-N174 HydrophobicContact CD2-CB 3.99Å; L163-W184 HydrophobicContact CD1-CE3 3.93Å; L163-W184 HydrophobicContact CD1-CZ3 3.54Å; L163-W184 HydrophobicContact CD2-CE3 4.04Å; L163-W184 HydrophobicContact CD2-CZ3 4.41Å; L163-M203 WeakPolarHBondContact O-CE 3.28Å; L163-L210 HydrophobicContact CD1-CD2 3.73Å
164	S	98.7	Very high	98	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	158.8	166.7	-167.9	0	0	0	0	109.7	L152 D154 I172 Y173	L152-S164 WeakPolarHBondContact CB-OG 3.39Å; D154-S164 WeakPolarHBondContact O-CA 3.45Å; D154-S164 WeakPolarHBondContact O-CB 3.37Å; D154-S164 PolarHBondContact O-OG 3.48Å; S164-I172 CarbonylContact O-C 3.59Å; S164-I172 WeakPolarHBondContact O-CA 3.32Å; S164-Y173 PolarHBondContact N-O 3.02Å; S164-Y173 PolarHBondContact O-N 3.16Å
165	V	98.7	Very high	98	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	136.9	179.8	67.5	0	0	0	0	110.2	L152 S153 F171 I172 L187 A200 M203 I212	L152-V165 WeakPolarHBondContact CA-O 3.34Å; S153-V165 PolarHBondContact N-O 2.88Å; S153-V165 VanDerWaalsContact N-O 3.07Å; V165-F171 WeakPolarHBondContact CA-O 3.49Å; V165-I172 HydrophobicContact CG2-CG1 4.17Å; V165-L187 HydrophobicContact CG2-CD1 4.23Å; V165-A200 HydrophobicContact CB-CB 4.12Å; V165-A200 HydrophobicContact CG1-CB 3.6Å; V165-A200 HydrophobicContact CG2-CB 3.38Å; V165-M203 HydrophobicContact CB-SD 4.17Å; V165-M203 HydrophobicContact CG1-CE 4.33Å; V165-M203 HydrophobicContact CG1-CG 4.18Å; V165-M203 HydrophobicContact CG1-SD 4.15Å; V165-I212 HydrophobicContact CG1-CG2 4.33Å; V165-I212 HydrophobicContact CG2-CG2 4.35Å
166	D	98.7	Very high	98	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	117.9	177.7	175.9	-19.5	0	0	0	110	A149 M150 E151 L152 R168 T169 G170 F171 Y173	A149-D166 WeakPolarHBondContact CA-OD2 3.35Å; M150-D166 PolarHBondContact N-OD2 2.84Å; E151-D166 WeakPolarHBondContact O-CA 3.48Å; L152-D166 HydrophobicContact CD2-CB 3.8Å; D166-R168 PolarHBondContact O-N 2.69Å; D166-R168 WeakPolarHBondContact OD1-CA 3.38Å; D166-R168 VanDerWaalsContact OD1-CB 3.31Å; D166-R168 WeakPolarHBondContact OD1-CB 3.42Å; D166-R168 PolarHBondContact OD1-N 2.96Å; D166-T169 WeakPolarHBondContact CB-OG1 3.36Å; D166-T169 PolarHBondContact OD1-N 2.9Å; D166-T169 VanDerWaalsContact OD1-N 3.1Å; D166-T169 VanDerWaalsContact OD2-CG2 3.25Å; D166-T169 WeakPolarHBondContact OD2-CG2 3.41Å; D166-T169 PolarHBondContact OD2-OG1 2.87Å; D166-G170 VanDerWaalsContact O-CA 3.28Å; D166-G170 WeakPolarHBondContact O-CA 3.37Å; D166-G170 PolarHBondContact O-N 2.89Å; D166-F171 PolarHBondContact N-O 3.2Å; D166-Y173 HydrophobicContact CB-CD2 4.3Å; D166-Y173 HydrophobicContact CB-CE2 3.74Å
167	D	98	Very high	97.8	Very high	5 Å²	5	33.5 Å²	33.5	3%	0.027	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.6	-12.6	-174.1	78.3	30.2	0	0	0	114.4	E151 S153 K199 A200	E151-D167 PolarHBondContact O-N 3.45Å; E151-D167 VanDerWaalsContact O-N 3.17Å; S153-D167 WeakPolarHBondContact OG-CB 3.4Å; S153-D167 PolarHBondContact OG-OD2 2.96Å; D167-K199 HydrophobicContact CB-CD 3.93Å; D167-K199 HydrophobicContact CB-CG 4.46Å; D167-K199 VanDerWaalsContact CG-NZ 3.28Å; D167-K199 WeakPolarHBondContact O-CA 3.19Å; D167-K199 IonicContact OD1-NZ 2.78Å; D167-K199 IonicContact OD2-NZ 3.73Å; D167-K199 PolarHBondContact OD2-NZ 3.5Å; D167-A200 VanDerWaalsContact CB-O 3.28Å; D167-A200 WeakPolarHBondContact CB-O 3.26Å
168	R	97.6	Very high	97.6	Very high	66 Å²	66	34.1 Å²	34.1	25%	0.249	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.6	-39.1	-179.6	-57.7	-55.6	-57.7	179	-2	111.1	Q145 R148 E151 D166	Q145-R168 WeakPolarHBondContact CB-O 3.45Å; Q145-R168 PolarHBondContact OE1-O 2.9Å; R148-R168 HydrophobicContact CB-CB 4.11Å; R148-R168 HydrophobicContact CB-CG 3.95Å; E151-R168 HydrophobicContact CB-CG 3.84Å; E151-R168 HydrophobicContact CG-CG 4.06Å; E151-R168 WeakPolarHBondContact OE2-CD 3.41Å; E151-R168 WeakPolarHBondContact OE2-CG 3.49Å; D166-R168 PolarHBondContact O-N 2.69Å; D166-R168 WeakPolarHBondContact OD1-CA 3.38Å; D166-R168 VanDerWaalsContact OD1-CB 3.31Å; D166-R168 WeakPolarHBondContact OD1-CB 3.42Å; D166-R168 PolarHBondContact OD1-N 2.96Å
169	T	98.1	Very high	97.5	Very high	3 Å²	3	37 Å²	37	2%	0.018	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.1	-20.7	-174.9	68	0	0	0	0	112.8	Q145 A149 D166 F171 F186 G197	Q145-T169 HydrophobicContact CB-CG2 4.27Å; A149-T169 HydrophobicContact CB-CG2 3.93Å; D166-T169 WeakPolarHBondContact CB-OG1 3.36Å; D166-T169 PolarHBondContact OD1-N 2.9Å; D166-T169 VanDerWaalsContact OD1-N 3.1Å; D166-T169 VanDerWaalsContact OD2-CG2 3.25Å; D166-T169 WeakPolarHBondContact OD2-CG2 3.41Å; D166-T169 PolarHBondContact OD2-OG1 2.87Å; T169-F171 PolarHBondContact O-N 3.19Å; T169-F171 PolarHBondContact OG1-N 2.75Å; T169-F186 WeakPolarHBondContact O-CD2 3.44Å; T169-F186 WeakPolarHBondContact O-CE2 2.84Å; T169-G197 WeakPolarHBondContact O-CA 3.3Å
170	G	98.2	Very high	97.6	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	20%	0.204	C	C	.	.			trans	72.8	10.7	-174	0	0	0	0	0	113.5	D166 L187	D166-G170 VanDerWaalsContact O-CA 3.28Å; D166-G170 WeakPolarHBondContact O-CA 3.37Å; D166-G170 PolarHBondContact O-N 2.89Å; G170-L187 WeakPolarHBondContact O-CB 3.18Å; G170-L187 WeakPolarHBondContact O-CG 3.19Å; G170-L187 PolarHBondContact O-N 2.9Å
171	F	98.4	Very high	97.7	Very high	45 Å²	45	33.2 Å²	33.2	20%	0.197	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	132.9	175.5	-80.5	-73.6	0	0	0	111.4	I143 V165 D166 T169 Y173 P183 I185 F186	I143-F171 HydrophobicContact CB-CE2 4.5Å; I143-F171 HydrophobicContact CG2-CD2 4.03Å; I143-F171 HydrophobicContact CG2-CE2 3.45Å; I143-F171 VanDerWaalsContact CG2-CE2 3.45Å; I143-F171 HydrophobicContact CG2-CZ 4.21Å; V165-F171 WeakPolarHBondContact CA-O 3.49Å; D166-F171 PolarHBondContact N-O 3.2Å; T169-F171 PolarHBondContact O-N 3.19Å; T169-F171 PolarHBondContact OG1-N 2.75Å; F171-Y173 HydrophobicContact CB-CD2 4.18Å; F171-Y173 HydrophobicContact CB-CE2 3.62Å; F171-P183 HydrophobicContact CD1-CB 4.11Å; F171-I185 CarbonylContact C-O 3.52Å; F171-I185 WeakPolarHBondContact CA-O 3.29Å; F171-F186 HydrophobicContact CD1-CB 4.07Å; F171-F186 HydrophobicContact CD2-CD2 4.48Å; F171-F186 HydrophobicContact CE1-CB 3.69Å; F171-F186 HydrophobicContact CE1-CD2 4.35Å; F171-F186 HydrophobicContact CE1-CG 4.48Å; F171-F186 HydrophobicContact CE2-CD2 4.14Å; F171-F186 HydrophobicContact CZ-CB 4.14Å; F171-F186 HydrophobicContact CZ-CD2 4.09Å
172	I	98.7	Very high	97.8	Very high	0 Å²	0	32 Å²	32	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	124.9	159.2	-55.1	177	0	0	0	107.4	L163 S164 V165 W184 I185 L187 L210 I212 V237	L163-I172 HydrophobicContact CB-CG2 4.03Å; L163-I172 HydrophobicContact CD1-CG2 4.17Å; L163-I172 HydrophobicContact CD2-CG2 4.33Å; L163-I172 HydrophobicContact CG-CG2 4.41Å; S164-I172 CarbonylContact O-C 3.59Å; S164-I172 WeakPolarHBondContact O-CA 3.32Å; V165-I172 HydrophobicContact CG2-CG1 4.17Å; I172-W184 HydrophobicContact CG2-CE3 4.02Å; I172-W184 PolarHBondContact O-N 2.88Å; I172-I185 HydrophobicContact CD1-CB 4.41Å; I172-I185 PolarHBondContact N-O 2.88Å; I172-L187 HydrophobicContact CD1-CD1 4.01Å; I172-L187 HydrophobicContact CD1-CD2 4.23Å; I172-L187 HydrophobicContact CD1-CG 4.28Å; I172-L187 HydrophobicContact CG1-CD1 3.91Å; I172-L187 HydrophobicContact CG1-CG 4.2Å; I172-L210 HydrophobicContact CD1-CD2 4.21Å; I172-I212 HydrophobicContact CD1-CD1 3.99Å; I172-I212 HydrophobicContact CD1-CG1 4.37Å; I172-V237 HydrophobicContact CD1-CG2 4.21Å
173	Y	98.7	Very high	97.8	Very high	3 Å²	3	33.6 Å²	33.6	1%	0.012	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	138	174.2	-68.1	-89.5	0	0	0	110.8	M150 L152 L163 S164 D166 F171 A181 V182 P183	M150-Y173 HydrophobicContact SD-CE1 4.44Å; M150-Y173 HydrophobicContact SD-CE2 4.39Å; L152-Y173 HydrophobicContact CD2-CD2 4.12Å; L152-Y173 HydrophobicContact CD2-CE2 4.46Å; L163-Y173 CarbonylContact C-O 3.59Å; L163-Y173 VanDerWaalsContact CA-O 3.22Å; L163-Y173 WeakPolarHBondContact CA-O 3.3Å; S164-Y173 PolarHBondContact N-O 3.02Å; S164-Y173 PolarHBondContact O-N 3.16Å; D166-Y173 HydrophobicContact CB-CD2 4.3Å; D166-Y173 HydrophobicContact CB-CE2 3.74Å; F171-Y173 HydrophobicContact CB-CD2 4.18Å; F171-Y173 HydrophobicContact CB-CE2 3.62Å; Y173-A181 HydrophobicContact CD1-CB 3.75Å; Y173-A181 HydrophobicContact CE1-CB 4.46Å; Y173-A181 HydrophobicContact CG-CB 4.1Å; Y173-V182 CarbonylContact C-O 3.45Å; Y173-V182 WeakPolarHBondContact CA-O 3.3Å; Y173-P183 HydrophobicContact CD1-CB 4.26Å; Y173-P183 HydrophobicContact CD1-CG 4.06Å; Y173-P183 HydrophobicContact CE1-CB 4.06Å; Y173-P183 HydrophobicContact CE1-CG 3.62Å
174	N	98.3	Very high	97.7	Very high	33 Å²	33	36.8 Å²	36.8	18%	0.176	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	118.3	162.7	176.5	33.1	0	0	0	109	R161 L162 L163 V176 V182	R161-N174 WeakPolarHBondContact CB-OD1 3.3Å; L162-N174 PolarHBondContact O-OD1 2.79Å; L163-N174 HydrophobicContact CD2-CB 3.99Å; N174-V176 WeakPolarHBondContact ND2-CG2 3.33Å; N174-V176 PolarHBondContact O-N 3.28Å; N174-V182 PolarHBondContact N-O 2.77Å; N174-V182 PolarHBondContact O-N 2.84Å
175	I	98.3	Very high	97.6	Very high	9 Å²	9	37.6 Å²	37.6	5%	0.046	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	107.6	178.3	-48.8	-51.4	0	0	0	108.7	F114 L139 L162 V180 A181	F114-I175 HydrophobicContact CD2-CG2 4.13Å; F114-I175 HydrophobicContact CE2-CG2 3.74Å; L139-I175 HydrophobicContact CD1-CD1 3.84Å; L139-I175 HydrophobicContact CD1-CG2 4.34Å; L139-I175 HydrophobicContact CD2-CG2 4.1Å; L162-I175 HydrophobicContact CB-CB 4.44Å; L162-I175 HydrophobicContact CD2-CB 4.21Å; L162-I175 HydrophobicContact CD2-CG2 4.48Å; L162-I175 HydrophobicContact CG-CB 4.25Å; L162-I175 PolarHBondContact O-N 2.82Å; I175-V180 CarbonylContact C-O 3.46Å; I175-V180 WeakPolarHBondContact CA-O 3.27Å; I175-A181 HydrophobicContact CD1-CB 3.84Å
176	V	97.9	Very high	97.5	Very high	49 Å²	49	41.7 Å²	41.7	30%	0.297	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	130.2	-177.2	-178.4	0	0	0	0	109.3	N174 E178 T179 V180 V182	N174-V176 WeakPolarHBondContact ND2-CG2 3.33Å; N174-V176 PolarHBondContact O-N 3.28Å; V176-E178 PolarHBondContact O-N 3.17Å; V176-E178 VanDerWaalsContact O-N 3.12Å; V176-T179 PolarHBondContact O-N 2.76Å; V176-V180 HydrophobicContact CB-CB 4.49Å; V176-V180 PolarHBondContact N-O 3.23Å; V176-V180 PolarHBondContact O-N 2.98Å; V176-V182 HydrophobicContact CG2-CG2 4.03Å
177	N	95.3	Very high	97.5	Very high	136 Å²	136	41.7 Å²	41.7	73%	0.727	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.9	34.8	178.2	-55.3	-30.8	0	0	0	113.4	T179	N177-T179 WeakPolarHBondContact O-CB 3.41Å; N177-T179 WeakPolarHBondContact O-CG2 2.86Å; N177-T179 PolarHBondContact O-N 3.41Å; N177-T179 PolarHBondContact O-OG1 2.62Å
178	E	93.5	Very high	97.5	Very high	78 Å²	78	42.1 Å²	42.1	36%	0.364	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.1	11.4	177.6	-55.8	-178.3	-171.3	0	0	115.2	F114 S137 V176	F114-E178 HydrophobicContact CD1-CB 4.12Å; F114-E178 HydrophobicContact CE1-CB 3.51Å; F114-E178 HydrophobicContact CE1-CG 3.67Å; F114-E178 HydrophobicContact CZ-CB 3.82Å; F114-E178 HydrophobicContact CZ-CG 3.73Å; S137-E178 WeakPolarHBondContact CB-O 3.3Å; S137-E178 PolarHBondContact OG-O 3.37Å; V176-E178 PolarHBondContact O-N 3.17Å; V176-E178 VanDerWaalsContact O-N 3.12Å
179	T	95.5	Very high	97.6	Very high	70 Å²	70	39.3 Å²	39.3	43%	0.429	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-140.6	-15.9	-166.9	48.7	0	0	0	0	114	L139 V176 N177	L139-T179 VanDerWaalsContact CD2-C 3.41Å; V176-T179 PolarHBondContact O-N 2.76Å; N177-T179 WeakPolarHBondContact O-CB 3.41Å; N177-T179 WeakPolarHBondContact O-CG2 2.86Å; N177-T179 PolarHBondContact O-N 3.41Å; N177-T179 PolarHBondContact O-OG1 2.62Å
180	V	97.9	Very high	97.5	Very high	77 Å²	77	39.2 Å²	39.2	47%	0.467	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	121.1	-177	-176	0	0	0	0	110.6	I175 V176 V182	I175-V180 CarbonylContact C-O 3.46Å; I175-V180 WeakPolarHBondContact CA-O 3.27Å; V176-V180 HydrophobicContact CB-CB 4.49Å; V176-V180 PolarHBondContact N-O 3.23Å; V176-V180 PolarHBondContact O-N 2.98Å; V180-V182 HydrophobicContact CG1-CG2 3.85Å
181	A	98.3	Very high	97.4	Very high	11 Å²	11	42.4 Å²	42.4	9%	0.091	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92	106.1	171.8	0	0	0	0	0	110	L139 M150 Y173 I175	L139-A181 HydrophobicContact CB-CB 4.42Å; M150-A181 HydrophobicContact CE-CB 3.95Å; Y173-A181 HydrophobicContact CD1-CB 3.75Å; Y173-A181 HydrophobicContact CE1-CB 4.46Å; Y173-A181 HydrophobicContact CG-CB 4.1Å; I175-A181 HydrophobicContact CD1-CB 3.84Å
182	V	98.3	Very high	97.4	Very high	66 Å²	66	41 Å²	41	40%	0.4	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	116.4	178.7	-177	0	0	0	0	109.5	Y173 N174 V176 V180 W184	Y173-V182 CarbonylContact C-O 3.45Å; Y173-V182 WeakPolarHBondContact CA-O 3.3Å; N174-V182 PolarHBondContact N-O 2.77Å; N174-V182 PolarHBondContact O-N 2.84Å; V176-V182 HydrophobicContact CG2-CG2 4.03Å; V180-V182 HydrophobicContact CG1-CG2 3.85Å; V182-W184 PolarHBondContact O-N 3.1Å
183	P	97.8	Very high	97.3	Very high	54 Å²	54	48.8 Å²	48.8	35%	0.351	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.7	134.4	175.9	-14.3	21.2	0	0	0	111	I143 F171 Y173	I143-P183 HydrophobicContact CD1-CB 4.38Å; I143-P183 HydrophobicContact CD1-CG 3.71Å; F171-P183 HydrophobicContact CD1-CB 4.11Å; Y173-P183 HydrophobicContact CD1-CB 4.26Å; Y173-P183 HydrophobicContact CD1-CG 4.06Å; Y173-P183 HydrophobicContact CE1-CB 4.06Å; Y173-P183 HydrophobicContact CE1-CG 3.62Å
184	W	97	Very high	97.2	Very high	67 Å²	67	51.8 Å²	51.8	25%	0.254	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	-60.4	179	177.7	31.1	0	0	0	112.4	F158 R161 L163 I172 V182 V237	F158-W184 HydrophobicContact CD1-CH2 4.29Å; F158-W184 HydrophobicContact CD1-CZ3 4.41Å; F158-W184 HydrophobicContact CE1-CH2 4.16Å; R161-W184 VanDerWaalsContact NH1-CE2 3.34Å; L163-W184 HydrophobicContact CD1-CE3 3.93Å; L163-W184 HydrophobicContact CD1-CZ3 3.54Å; L163-W184 HydrophobicContact CD2-CE3 4.04Å; L163-W184 HydrophobicContact CD2-CZ3 4.41Å; I172-W184 HydrophobicContact CG2-CE3 4.02Å; I172-W184 PolarHBondContact O-N 2.88Å; V182-W184 PolarHBondContact O-N 3.1Å; W184-V237 HydrophobicContact CH2-CG1 4.01Å; W184-V237 HydrophobicContact CZ3-CG1 4.4Å
185	I	96.7	Very high	97	Very high	18 Å²	18	57 Å²	57	9%	0.092	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	137.9	-174.1	-68.8	168.1	0	0	0	109.3	F171 I172 L187 V237 G241 V243	F171-I185 CarbonylContact C-O 3.52Å; F171-I185 WeakPolarHBondContact CA-O 3.29Å; I172-I185 HydrophobicContact CD1-CB 4.41Å; I172-I185 PolarHBondContact N-O 2.88Å; I185-L187 HydrophobicContact CG2-CD2 3.92Å; I185-V237 HydrophobicContact CD1-CG1 3.49Å; I185-V237 VanDerWaalsContact CD1-CG1 3.49Å; I185-G241 VanDerWaalsContact CD1-CA 3.4Å; I185-V243 HydrophobicContact CG2-CG2 3.59Å
186	F	97.3	Very high	96.9	Very high	86 Å²	86	59.6 Å²	59.6	38%	0.377	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	131.8	168.3	172.9	-102.4	0	0	0	110.4	T169 F171 A188	T169-F186 WeakPolarHBondContact O-CD2 3.44Å; T169-F186 WeakPolarHBondContact O-CE2 2.84Å; F171-F186 HydrophobicContact CD1-CB 4.07Å; F171-F186 HydrophobicContact CD2-CD2 4.48Å; F171-F186 HydrophobicContact CE1-CB 3.69Å; F171-F186 HydrophobicContact CE1-CD2 4.35Å; F171-F186 HydrophobicContact CE1-CG 4.48Å; F171-F186 HydrophobicContact CE2-CD2 4.14Å; F171-F186 HydrophobicContact CZ-CB 4.14Å; F171-F186 HydrophobicContact CZ-CD2 4.09Å; F186-A188 HydrophobicContact CE1-CB 3.86Å
187	L	98.5	Very high	96.9	Very high	0 Å²	0	57.5 Å²	57.5	0%	0	31%	0.309	C	S	.	.			trans	-106.5	107.3	175.2	-55.9	178.8	0	0	0	109	V165 G170 I172 I185 F198 I212 K235 V237 V243	V165-L187 HydrophobicContact CG2-CD1 4.23Å; G170-L187 WeakPolarHBondContact O-CB 3.18Å; G170-L187 WeakPolarHBondContact O-CG 3.19Å; G170-L187 PolarHBondContact O-N 2.9Å; I172-L187 HydrophobicContact CD1-CD1 4.01Å; I172-L187 HydrophobicContact CD1-CD2 4.23Å; I172-L187 HydrophobicContact CD1-CG 4.28Å; I172-L187 HydrophobicContact CG1-CD1 3.91Å; I172-L187 HydrophobicContact CG1-CG 4.2Å; I185-L187 HydrophobicContact CG2-CD2 3.92Å; L187-F198 HydrophobicContact CB-CB 3.77Å; L187-F198 HydrophobicContact CB-CD1 4.36Å; L187-F198 HydrophobicContact CB-CG 4.47Å; L187-F198 HydrophobicContact CD1-CD1 4.08Å; L187-F198 VanDerWaalsContact O-CB 3.3Å; L187-F198 WeakPolarHBondContact O-CB 3.29Å; L187-F198 PolarHBondContact O-N 2.58Å; L187-I212 HydrophobicContact CD1-CB 4.31Å; L187-I212 HydrophobicContact CD1-CD1 4.47Å; L187-I212 HydrophobicContact CD1-CG1 4.43Å; L187-I212 HydrophobicContact CD1-CG2 4.16Å; L187-K235 HydrophobicContact CB-CG 4.39Å; L187-K235 HydrophobicContact CD1-CB 4.31Å; L187-K235 HydrophobicContact CD1-CG 4.17Å; L187-K235 HydrophobicContact CD2-CB 4.11Å; L187-K235 HydrophobicContact CD2-CG 4.26Å; L187-V237 HydrophobicContact CD2-CG2 4.27Å; L187-V243 HydrophobicContact CD2-CG1 3.87Å; L187-V243 HydrophobicContact CD2-CG2 4.04Å
188	A	98.1	Very high	97	Very high	13 Å²	13	51 Å²	51	11%	0.107	27%	0.274	C	S	.	.	B	Isolated β-bridge	trans	-67.3	143.3	168.5	0	0	0	0	0	110.5	F186 K235	F186-A188 HydrophobicContact CE1-CB 3.86Å; A188-K235 WeakPolarHBondContact O-CE 3.38Å
189	D	98.1	Very high	97.2	Very high	8 Å²	8	49.5 Å²	49.5	4%	0.043	27%	0.267	C	S	.	.	S	Bend	trans	-67.2	164.9	-177.7	-158	0.4	0	0	0	113.4	D191 G192 H194 K196 F198	D189-D191 PolarHBondContact O-N 3.29Å; D189-G192 PolarHBondContact O-N 3.34Å; D189-H194 HydrophobicContact CB-CB 4.09Å; D189-H194 PolarHBondContact O-CD2 3.09Å; D189-K196 HydrophobicContact CB-CD 4.08Å; D189-K196 HydrophobicContact CB-CG 3.61Å; D189-K196 PolarHBondContact N-O 3.06Å; D189-K196 WeakPolarHBondContact OD2-CD 3.21Å; D189-K196 WeakPolarHBondContact OD2-CE 3.48Å; D189-K196 IonicContact OD2-NZ 3.35Å; D189-K196 PolarHBondContact OD2-NZ 2.82Å; D189-F198 VanDerWaalsContact OD1-CD2 3.29Å; D189-F198 WeakPolarHBondContact OD1-CD2 3.4Å
190	G	97.1	Very high	97.4	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	55	-127.8	175.7	0	0	0	0	0	112.8	G192 W233 K235	G190-G192 PolarHBondContact O-N 2.9Å; G190-W233 VanDerWaalsContact C-CD2 3.44Å; G190-W233 WeakPolarHBondContact O-CB 3.42Å; G190-W233 VanDerWaalsContact O-CG 3.31Å; G190-K235 PolarHBondContact O-NZ 3.36Å
191	D	96.9	Very high	97.4	Very high	68 Å²	68	42.6 Å²	42.6	36%	0.364	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.8	1.7	179.5	70.9	-5.6	0	0	0	114.6	D189 Q193 H194 W233	D189-D191 PolarHBondContact O-N 3.29Å; D191-Q193 WeakPolarHBondContact OD1-CB 3.26Å; D191-Q193 PolarHBondContact OD1-N 2.86Å; D191-H194 IonicContact OD1-CD2 3.94Å; D191-H194 PolarHBondContact OD1-CD2 3Å; D191-H194 IonicContact OD1-NE2 2.72Å; D191-W233 HydrophobicContact CB-CD2 4.39Å; D191-W233 HydrophobicContact CB-CE3 4.36Å; D191-W233 HydrophobicContact CB-CH2 3.36Å; D191-W233 HydrophobicContact CB-CZ2 3.38Å; D191-W233 HydrophobicContact CB-CZ3 3.88Å
192	G	97.5	Very high	97.4	Very high	14 Å²	14	42.1 Å²	42.1	14%	0.144	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	88.9	1.1	-177.2	0	0	0	0	0	114.7	D189 G190 H245	D189-G192 PolarHBondContact O-N 3.34Å; G190-G192 PolarHBondContact O-N 2.9Å; G192-H245 WeakPolarHBondContact CA-CE1 3.38Å; G192-H245 WeakPolarHBondContact CA-ND1 3.49Å; G192-H245 PolarHBondContact N-ND1 2.81Å
193	Q	96.9	Very high	97.4	Very high	164 Å²	164	39 Å²	39	77%	0.766	20%	0.201	S	C	*	.	T	Hydrogen-bonded Turn	trans	-100	18.2	177	-56	-56.3	-62.4	0	0	113	D191	D191-Q193 WeakPolarHBondContact OD1-CB 3.26Å; D191-Q193 PolarHBondContact OD1-N 2.86Å
194	H	95.8	Very high	97.5	Very high	67 Å²	67	36.4 Å²	36.4	31%	0.31	18%	0.184	S	C	.	.			trans	-101.8	148.5	178.5	-64.8	-96.7	0	0	0	112.1	D189 D191 K196 D230	D189-H194 HydrophobicContact CB-CB 4.09Å; D189-H194 PolarHBondContact O-CD2 3.09Å; D191-H194 IonicContact OD1-CD2 3.94Å; D191-H194 PolarHBondContact OD1-CD2 3Å; D191-H194 IonicContact OD1-NE2 2.72Å; H194-K196 HydrophobicContact CB-CG 4.21Å; H194-D230 IonicContact CE1-OD1 3.65Å; H194-D230 IonicContact CE1-OD2 2.82Å; H194-D230 IonicContact NE2-OD1 3.71Å
195	T	94	Very high	97.5	Very high	142 Å²	142	35.2 Å²	35.2	87%	0.871	18%	0.184	S	C	*	.	S	Bend	trans	-84.3	-11.2	177	55.3	0	0	0	0	113.7
196	K	96.2	Very high	97.6	Very high	63 Å²	63	34.7 Å²	34.7	27%	0.274	18%	0.182	S	C	.	.	S	Bend	trans	-86.3	152.7	174.9	61.9	170.5	164	148.3	0	110.9	D189 H194 D230	D189-K196 HydrophobicContact CB-CD 4.08Å; D189-K196 HydrophobicContact CB-CG 3.61Å; D189-K196 PolarHBondContact N-O 3.06Å; D189-K196 WeakPolarHBondContact OD2-CD 3.21Å; D189-K196 WeakPolarHBondContact OD2-CE 3.48Å; D189-K196 IonicContact OD2-NZ 3.35Å; D189-K196 PolarHBondContact OD2-NZ 2.82Å; H194-K196 HydrophobicContact CB-CG 4.21Å; K196-D230 IonicContact NZ-OD2 3.69Å; K196-D230 PolarHBondContact NZ-OD2 2.91Å
197	G	97.9	Very high	97.4	Very high	5 Å²	5	32.5 Å²	32.5	5%	0.052	17%	0.174	C	C	.	.	B	Isolated β-bridge	trans	-67.8	150.7	170	0	0	0	0	0	111	T169	T169-G197 WeakPolarHBondContact O-CA 3.3Å
198	F	98.4	Very high	97.3	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	20%	0.198	C	C	.	.	P	Polyproline II helix	trans	-71.2	128.3	177.5	-178.5	-126.3	0	0	0	111.2	L187 D189 A200 I212 W233 K235	L187-F198 HydrophobicContact CB-CB 3.77Å; L187-F198 HydrophobicContact CB-CD1 4.36Å; L187-F198 HydrophobicContact CB-CG 4.47Å; L187-F198 HydrophobicContact CD1-CD1 4.08Å; L187-F198 VanDerWaalsContact O-CB 3.3Å; L187-F198 WeakPolarHBondContact O-CB 3.29Å; L187-F198 PolarHBondContact O-N 2.58Å; D189-F198 VanDerWaalsContact OD1-CD2 3.29Å; D189-F198 WeakPolarHBondContact OD1-CD2 3.4Å; F198-A200 VanDerWaalsContact C-N 3.27Å; F198-A200 HydrophobicContact CD1-CB 3.74Å; F198-A200 HydrophobicContact CE1-CB 3.98Å; F198-A200 PolarHBondContact O-N 2.82Å; F198-I212 HydrophobicContact CE1-CG2 4.17Å; F198-W233 HydrophobicContact CE2-CB 4.46Å; F198-W233 WeakPolarHBondContact CZ-O 3.28Å; F198-K235 HydrophobicContact CD1-CD 4.49Å; F198-K235 HydrophobicContact CD1-CG 3.61Å; F198-K235 HydrophobicContact CE1-CG 3.62Å; F198-K235 VanDerWaalsContact CE2-NZ 3.27Å; F198-K235 HydrophobicContact CG-CG 4.15Å; F198-K235 HydrophobicContact CZ-CG 4.16Å
199	K	97.7	Very high	97.3	Very high	47 Å²	47	39.8 Å²	39.8	20%	0.204	21%	0.207	C	C	.	.			trans	-71.8	86.4	167.7	-174.8	86.9	167.9	91.8	0	108.3	D167 E201 G214	D167-K199 HydrophobicContact CB-CD 3.93Å; D167-K199 HydrophobicContact CB-CG 4.46Å; D167-K199 VanDerWaalsContact CG-NZ 3.28Å; D167-K199 WeakPolarHBondContact O-CA 3.19Å; D167-K199 IonicContact OD1-NZ 2.78Å; D167-K199 IonicContact OD2-NZ 3.73Å; D167-K199 PolarHBondContact OD2-NZ 3.5Å; K199-E201 WeakPolarHBondContact CE-OE1 3.49Å; K199-E201 VanDerWaalsContact CG-OE1 3.32Å; K199-E201 WeakPolarHBondContact CG-OE1 3.37Å; K199-E201 IonicContact NZ-OE1 3.84Å; K199-E201 PolarHBondContact NZ-OE1 3.5Å; K199-E201 IonicContact NZ-OE2 3.9Å; K199-G214 WeakPolarHBondContact O-CA 3.5Å
200	A	98.3	Very high	97.3	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	21%	0.205	C	C	.	.			trans	-90.2	133.3	179	0	0	0	0	0	109.8	S153 V165 D167 F198 I212	S153-A200 WeakPolarHBondContact CB-O 3.5Å; S153-A200 PolarHBondContact OG-O 3.2Å; V165-A200 HydrophobicContact CB-CB 4.12Å; V165-A200 HydrophobicContact CG1-CB 3.6Å; V165-A200 HydrophobicContact CG2-CB 3.38Å; D167-A200 VanDerWaalsContact CB-O 3.28Å; D167-A200 WeakPolarHBondContact CB-O 3.26Å; F198-A200 VanDerWaalsContact C-N 3.27Å; F198-A200 HydrophobicContact CD1-CB 3.74Å; F198-A200 HydrophobicContact CE1-CB 3.98Å; F198-A200 PolarHBondContact O-N 2.82Å; A200-I212 HydrophobicContact CB-CG2 3.53Å
201	E	98.5	Very high	97.4	Very high	2 Å²	2	39.5 Å²	39.5	1%	0.009	21%	0.206	C	C	.	.			trans	-122.9	-32.5	-174.6	-59.2	-70.7	174.2	0	0	112.4	K199 G213 I215 E270	K199-E201 WeakPolarHBondContact CE-OE1 3.49Å; K199-E201 VanDerWaalsContact CG-OE1 3.32Å; K199-E201 WeakPolarHBondContact CG-OE1 3.37Å; K199-E201 IonicContact NZ-OE1 3.84Å; K199-E201 PolarHBondContact NZ-OE1 3.5Å; K199-E201 IonicContact NZ-OE2 3.9Å; E201-G213 PolarHBondContact N-O 2.91Å; E201-I215 HydrophobicContact CG-CB 4.37Å; E201-I215 HydrophobicContact CG-CG2 3.49Å; E201-I215 VanDerWaalsContact CG-CG2 3.49Å; E201-I215 WeakPolarHBondContact OE1-CG2 3.23Å; E201-E270 HydrophobicContact CB-CB 4.46Å; E201-E270 HydrophobicContact CB-CG 4.19Å; E201-E270 HydrophobicContact CG-CG 4.49Å
202	W	98.8	Very high	97.5	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	155.1	-178.6	55	-95.2	0	0	0	112.4	A204 I212 G213 G214 V234 W248 Y252 E270 A272 F283	W202-A204 HydrophobicContact CE3-CB 4.46Å; W202-A204 HydrophobicContact CZ3-CB 4.34Å; W202-I212 VanDerWaalsContact O-CA 3.3Å; W202-I212 WeakPolarHBondContact O-CA 3.4Å; W202-G213 VanDerWaalsContact CE2-CA 3.41Å; W202-G213 VanDerWaalsContact CZ2-CA 3.47Å; W202-G213 PolarHBondContact N-O 3.47Å; W202-G213 PolarHBondContact O-N 2.94Å; W202-G213 VanDerWaalsContact O-N 3.1Å; W202-G214 PolarHBondContact NE1-O 3.45Å; W202-V234 HydrophobicContact CH2-CG1 4.14Å; W202-V234 HydrophobicContact CH2-CG2 3.98Å; W202-V234 HydrophobicContact CZ2-CG2 3.89Å; W202-W248 HydrophobicContact CH2-CE3 4.28Å; W202-W248 HydrophobicContact CH2-CH2 4.04Å; W202-W248 AromaticContact CH2-CZ3 3.65Å; W202-W248 HydrophobicContact CH2-CZ3 3.65Å; W202-W248 HydrophobicContact CZ2-CE3 4.33Å; W202-W248 HydrophobicContact CZ2-CZ3 4.04Å; W202-Y252 WeakPolarHBondContact CZ2-OH 3.22Å; W202-Y252 PolarHBondContact NE1-OH 3.35Å; W202-E270 WeakPolarHBondContact CB-O 3.1Å; W202-A272 HydrophobicContact CB-CB 4.31Å; W202-A272 HydrophobicContact CD2-CB 3.56Å; W202-A272 HydrophobicContact CE3-CB 3.66Å; W202-A272 HydrophobicContact CG-CB 3.87Å; W202-A272 HydrophobicContact CZ2-CB 4.49Å; W202-A272 HydrophobicContact CZ3-CB 4.2Å; W202-F283 HydrophobicContact CZ2-CE1 4.18Å; W202-F283 HydrophobicContact CZ2-CZ 4.4Å
203	M	98.8	Very high	97.6	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	133.7	177.1	-67	-169.7	-72.3	0	0	112.3	D154 K156 L163 V165 L210 Y211 I212 Q273	D154-M203 HydrophobicContact CB-CB 4.38Å; D154-M203 HydrophobicContact CB-CE 3.75Å; D154-M203 HydrophobicContact CB-CG 4.28Å; D154-M203 WeakPolarHBondContact O-CE 3.31Å; D154-M203 PolarHBondContact OD2-N 3.15Å; K156-M203 HydrophobicContact CB-CB 3.9Å; K156-M203 HydrophobicContact CB-CE 4.1Å; K156-M203 HydrophobicContact CB-SD 4.38Å; K156-M203 HydrophobicContact CG-CB 4.46Å; L163-M203 WeakPolarHBondContact O-CE 3.28Å; V165-M203 HydrophobicContact CB-SD 4.17Å; V165-M203 HydrophobicContact CG1-CE 4.33Å; V165-M203 HydrophobicContact CG1-CG 4.18Å; V165-M203 HydrophobicContact CG1-SD 4.15Å; M203-L210 HydrophobicContact CB-CD1 4.2Å; M203-Y211 CarbonylContact C-O 3.56Å; M203-Y211 VanDerWaalsContact CA-O 3.29Å; M203-Y211 WeakPolarHBondContact CA-O 3.48Å; M203-I212 HydrophobicContact CG-CG1 3.97Å; M203-I212 HydrophobicContact CG-CG2 4.16Å; M203-I212 HydrophobicContact SD-CG1 4.45Å; M203-Q273 PolarHBondContact O-NE2 2.76Å
204	A	98.7	Very high	97.6	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	151.3	177.5	0	0	0	0	0	111.3	W202 Y211 W281	W202-A204 HydrophobicContact CE3-CB 4.46Å; W202-A204 HydrophobicContact CZ3-CB 4.34Å; A204-Y211 PolarHBondContact N-O 2.99Å; A204-Y211 PolarHBondContact O-N 3.29Å; A204-W281 HydrophobicContact CB-CH2 4.32Å; A204-W281 HydrophobicContact CB-CZ3 3.69Å
205	V	98.4	Very high	97.7	Very high	42 Å²	42	25.2 Å²	25.2	26%	0.255	13%	0.133	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	126.6	174	178	0	0	0	0	109.7	K156 F158 K209 L210	K156-V205 HydrophobicContact CD-CG2 4.48Å; K156-V205 HydrophobicContact CG-CG2 3.88Å; F158-V205 HydrophobicContact CB-CG2 4.19Å; F158-V205 HydrophobicContact CD2-CG1 4.15Å; F158-V205 HydrophobicContact CD2-CG2 3.78Å; F158-V205 HydrophobicContact CE2-CG1 4.47Å; F158-V205 HydrophobicContact CG-CG2 4.4Å; V205-K209 WeakPolarHBondContact CA-O 3.34Å; V205-L210 HydrophobicContact CG2-CD1 4.15Å
206	K	97.4	Very high	97.9	Very high	8 Å²	8	18.6 Å²	18.6	4%	0.035	9%	0.093	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	132.4	175	177.2	178.2	-171.1	-62.6	0	109.7	D208 K209 Y211 W274 W281	K206-D208 VanDerWaalsContact C-N 3.31Å; K206-D208 PolarHBondContact O-N 2.86Å; K206-K209 PolarHBondContact N-O 2.93Å; K206-K209 PolarHBondContact O-N 3.04Å; K206-Y211 HydrophobicContact CB-CD2 3.97Å; K206-Y211 HydrophobicContact CB-CE2 3.68Å; K206-Y211 HydrophobicContact CG-CE2 4.34Å; K206-Y211 WeakPolarHBondContact O-CE2 3.49Å; K206-W274 HydrophobicContact CB-CB 3.94Å; K206-W274 HydrophobicContact CB-CD2 4.45Å; K206-W274 HydrophobicContact CB-CG 3.79Å; K206-W274 HydrophobicContact CD-CB 4.41Å; K206-W274 HydrophobicContact CD-CD2 3.55Å; K206-W274 HydrophobicContact CD-CE3 3.83Å; K206-W274 HydrophobicContact CD-CG 3.81Å; K206-W274 HydrophobicContact CD-CZ2 4.37Å; K206-W274 HydrophobicContact CD-CZ3 4.35Å; K206-W274 HydrophobicContact CG-CB 4.4Å; K206-W274 HydrophobicContact CG-CD2 3.93Å; K206-W274 HydrophobicContact CG-CG 3.75Å; K206-W281 HydrophobicContact CB-CH2 4.21Å; K206-W281 HydrophobicContact CB-CZ2 4.39Å; K206-W281 HydrophobicContact CD-CH2 4.05Å; K206-W281 HydrophobicContact CD-CZ2 3.4Å
207	D	94.6	Very high	98	Very high	40 Å²	40	16.1 Å²	16.1	21%	0.214	8%	0.083	C	C	.	.	T	Hydrogen-bonded Turn	trans	47.6	51.4	177.7	-50.3	-33.8	0	0	0	113.3	K209	D207-K209 PolarHBondContact O-N 3.1Å; D207-K209 VanDerWaalsContact O-N 3.16Å; D207-K209 PolarHBondContact O-NZ 3.35Å; D207-K209 VanDerWaalsContact O-NZ 3.08Å
208	D	95.4	Very high	98	Very high	97 Å²	97	16.6 Å²	16.6	52%	0.519	8%	0.084	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.3	24	-179.6	-55.2	-39.9	0	0	0	114.9	N73 F158 K206	N73-D208 PolarHBondContact ND2-OD1 2.71Å; N73-D208 PolarHBondContact ND2-OD2 2.78Å; F158-D208 WeakPolarHBondContact CE2-O 3.34Å; K206-D208 VanDerWaalsContact C-N 3.31Å; K206-D208 PolarHBondContact O-N 2.86Å
209	K	98.2	Very high	98	Very high	68 Å²	68	21 Å²	21	30%	0.296	10%	0.101	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	147.4	175.1	-63.4	176	-160.6	68.3	0	110.9	V205 K206 D207 Y211 I236 V237	V205-K209 WeakPolarHBondContact CA-O 3.34Å; K206-K209 PolarHBondContact N-O 2.93Å; K206-K209 PolarHBondContact O-N 3.04Å; D207-K209 PolarHBondContact O-N 3.1Å; D207-K209 VanDerWaalsContact O-N 3.16Å; D207-K209 PolarHBondContact O-NZ 3.35Å; D207-K209 VanDerWaalsContact O-NZ 3.08Å; K209-Y211 HydrophobicContact CB-CD2 4.44Å; K209-Y211 HydrophobicContact CB-CE2 4.01Å; K209-I236 HydrophobicContact CB-CG2 3.8Å; K209-I236 HydrophobicContact CD-CG2 3.63Å; K209-I236 HydrophobicContact CG-CG2 4.25Å; K209-V237 WeakPolarHBondContact CA-O 3.44Å
210	L	98.6	Very high	98	Very high	0 Å²	0	19.7 Å²	19.7	0%	0	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	120.2	171.9	-178.1	69	0	0	0	108.9	K156 F158 L163 I172 M203 V205 I212 I236 V237	K156-L210 HydrophobicContact CB-CD1 4.26Å; K156-L210 HydrophobicContact CG-CD1 4.06Å; F158-L210 HydrophobicContact CB-CD1 4.27Å; F158-L210 HydrophobicContact CD1-CB 3.9Å; F158-L210 HydrophobicContact CD1-CD2 4.32Å; F158-L210 HydrophobicContact CD2-CB 4.11Å; F158-L210 HydrophobicContact CE1-CB 4Å; F158-L210 HydrophobicContact CE2-CB 4.22Å; F158-L210 HydrophobicContact CG-CB 3.94Å; F158-L210 HydrophobicContact CG-CD1 4.46Å; F158-L210 HydrophobicContact CZ-CB 4.16Å; L163-L210 HydrophobicContact CD1-CD2 3.73Å; I172-L210 HydrophobicContact CD1-CD2 4.21Å; M203-L210 HydrophobicContact CB-CD1 4.2Å; V205-L210 HydrophobicContact CG2-CD1 4.15Å; L210-I212 HydrophobicContact CB-CD1 4.39Å; L210-I212 HydrophobicContact CD2-CD1 3.85Å; L210-I212 HydrophobicContact CD2-CG1 4.2Å; L210-I212 HydrophobicContact CG-CD1 3.7Å; L210-I212 HydrophobicContact CG-CG1 4.04Å; L210-I236 CarbonylContact O-C 3.59Å; L210-I236 WeakPolarHBondContact O-CA 3.22Å; L210-V237 HydrophobicContact CB-CB 4.29Å; L210-V237 PolarHBondContact N-O 3.16Å; L210-V237 PolarHBondContact O-N 2.68Å
211	Y	98.7	Very high	97.9	Very high	2 Å²	2	22.1 Å²	22.1	1%	0.008	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	129.2	172.8	-72.7	-109.3	0	0	0	108	G63 M203 A204 K206 K209 V234 K235 I236 W248 W281	G63-Y211 PolarHBondContact O-OH 3.34Å; M203-Y211 CarbonylContact C-O 3.56Å; M203-Y211 VanDerWaalsContact CA-O 3.29Å; M203-Y211 WeakPolarHBondContact CA-O 3.48Å; A204-Y211 PolarHBondContact N-O 2.99Å; A204-Y211 PolarHBondContact O-N 3.29Å; K206-Y211 HydrophobicContact CB-CD2 3.97Å; K206-Y211 HydrophobicContact CB-CE2 3.68Å; K206-Y211 HydrophobicContact CG-CE2 4.34Å; K206-Y211 WeakPolarHBondContact O-CE2 3.49Å; K209-Y211 HydrophobicContact CB-CD2 4.44Å; K209-Y211 HydrophobicContact CB-CE2 4.01Å; Y211-V234 HydrophobicContact CD1-CG1 4.05Å; Y211-K235 CarbonylContact C-O 3.56Å; Y211-K235 WeakPolarHBondContact CA-O 3.33Å; Y211-I236 HydrophobicContact CD1-CD1 4.06Å; Y211-I236 HydrophobicContact CD1-CG1 3.76Å; Y211-I236 HydrophobicContact CD2-CG2 4.49Å; Y211-I236 HydrophobicContact CE1-CD1 3.42Å; Y211-I236 VanDerWaalsContact CE1-CD1 3.42Å; Y211-I236 HydrophobicContact CE1-CG1 3.64Å; Y211-I236 HydrophobicContact CE1-CG2 4.32Å; Y211-I236 HydrophobicContact CE2-CG2 4.13Å; Y211-I236 HydrophobicContact CG-CG1 4.42Å; Y211-W248 HydrophobicContact CD1-CH2 4.03Å; Y211-W248 AromaticContact CD1-CZ2 3.67Å; Y211-W248 HydrophobicContact CD1-CZ2 3.67Å; Y211-W248 HydrophobicContact CE1-CH2 4.48Å; Y211-W248 AromaticContact CE1-CZ2 3.83Å; Y211-W248 HydrophobicContact CE1-CZ2 3.83Å; Y211-W281 HydrophobicContact CD1-CH2 4.08Å; Y211-W281 HydrophobicContact CD1-CZ2 4.28Å; Y211-W281 HydrophobicContact CD2-CH2 4.31Å; Y211-W281 HydrophobicContact CE1-CZ2 4.38Å; Y211-W281 AromaticContact CG-CH2 3.95Å; Y211-W281 HydrophobicContact CG-CH2 3.95Å
212	I	98.8	Very high	97.7	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	119.8	177.5	-50	92.4	0	0	0	107.9	V165 I172 L187 F198 A200 W202 M203 L210 V234 K235 V237	V165-I212 HydrophobicContact CG1-CG2 4.33Å; V165-I212 HydrophobicContact CG2-CG2 4.35Å; I172-I212 HydrophobicContact CD1-CD1 3.99Å; I172-I212 HydrophobicContact CD1-CG1 4.37Å; L187-I212 HydrophobicContact CD1-CB 4.31Å; L187-I212 HydrophobicContact CD1-CD1 4.47Å; L187-I212 HydrophobicContact CD1-CG1 4.43Å; L187-I212 HydrophobicContact CD1-CG2 4.16Å; F198-I212 HydrophobicContact CE1-CG2 4.17Å; A200-I212 HydrophobicContact CB-CG2 3.53Å; W202-I212 VanDerWaalsContact O-CA 3.3Å; W202-I212 WeakPolarHBondContact O-CA 3.4Å; M203-I212 HydrophobicContact CG-CG1 3.97Å; M203-I212 HydrophobicContact CG-CG2 4.16Å; M203-I212 HydrophobicContact SD-CG1 4.45Å; L210-I212 HydrophobicContact CB-CD1 4.39Å; L210-I212 HydrophobicContact CD2-CD1 3.85Å; L210-I212 HydrophobicContact CD2-CG1 4.2Å; L210-I212 HydrophobicContact CG-CD1 3.7Å; L210-I212 HydrophobicContact CG-CG1 4.04Å; I212-V234 CarbonylContact O-C 3.59Å; I212-V234 WeakPolarHBondContact O-CA 3.36Å; I212-K235 HydrophobicContact CB-CB 4.33Å; I212-K235 HydrophobicContact CD1-CB 4.35Å; I212-K235 PolarHBondContact N-O 3.38Å; I212-K235 PolarHBondContact O-N 2.97Å; I212-V237 HydrophobicContact CD1-CB 4.34Å; I212-V237 HydrophobicContact CD1-CG2 3.62Å
213	G	98.7	Very high	97.5	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	162	-179.2	0	0	0	0	0	113.5	E201 W202	E201-G213 PolarHBondContact N-O 2.91Å; W202-G213 VanDerWaalsContact CE2-CA 3.41Å; W202-G213 VanDerWaalsContact CZ2-CA 3.47Å; W202-G213 PolarHBondContact N-O 3.47Å; W202-G213 PolarHBondContact O-N 2.94Å; W202-G213 VanDerWaalsContact O-N 3.1Å
214	G	98	Very high	97.3	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	15%	0.154	C	C	.	.			trans	-93	-171.1	173	0	0	0	0	0	112.1	K199 W202 G216 Y252	K199-G214 WeakPolarHBondContact O-CA 3.5Å; W202-G214 PolarHBondContact NE1-O 3.45Å; G214-G216 PolarHBondContact O-N 3.23Å; G214-Y252 PolarHBondContact O-OH 2.72Å
215	I	97.7	Very high	97.2	Very high	13 Å²	13	37 Å²	37	7%	0.067	18%	0.182	C	C	.	.			trans	-57	-19.7	-176	55.6	171.2	0	0	0	114.8	E201 K217 W219 P231 I268 H269	E201-I215 HydrophobicContact CG-CB 4.37Å; E201-I215 HydrophobicContact CG-CG2 3.49Å; E201-I215 VanDerWaalsContact CG-CG2 3.49Å; E201-I215 WeakPolarHBondContact OE1-CG2 3.23Å; I215-K217 HydrophobicContact CD1-CD 4.43Å; I215-K217 HydrophobicContact CD1-CG 3.72Å; I215-K217 HydrophobicContact CG1-CG 4.14Å; I215-K217 PolarHBondContact O-N 2.93Å; I215-W219 HydrophobicContact CD1-CE3 4.27Å; I215-W219 HydrophobicContact CD1-CZ3 4.41Å; I215-P231 HydrophobicContact CD1-CB 3.96Å; I215-P231 HydrophobicContact CD1-CG 4.16Å; I215-P231 HydrophobicContact CG1-CB 3.36Å; I215-P231 HydrophobicContact CG1-CG 4.1Å; I215-I268 HydrophobicContact CB-CG2 4.2Å; I215-I268 HydrophobicContact CG2-CG2 4.1Å; I215-H269 WeakPolarHBondContact CA-O 3.42Å; I215-H269 PolarHBondContact O-N 3.27Å
216	G	98.2	Very high	97.2	Very high	3 Å²	3	40.5 Å²	40.5	3%	0.031	19%	0.192	C	C	.	.			trans	73.8	23.2	172.9	0	0	0	0	0	115.8	G214 P231 F232 Y252	G214-G216 PolarHBondContact O-N 3.23Å; G216-P231 PolarHBondContact N-O 3.34Å; G216-P231 VanDerWaalsContact N-O 3.12Å; G216-F232 WeakPolarHBondContact O-CE1 3.47Å; G216-Y252 VanDerWaalsContact CA-CD1 3.46Å; G216-Y252 VanDerWaalsContact CA-CE1 3.44Å; G216-Y252 WeakPolarHBondContact O-CB 3.47Å
217	K	98	Very high	97.3	Very high	11 Å²	11	43.8 Å²	43.8	5%	0.048	21%	0.212	C	C	.	.	S	Bend	trans	-131.4	170	170.4	67.1	168.1	-171.1	74	0	111.2	I215 W219 P231 F232 Y266 I268	I215-K217 HydrophobicContact CD1-CD 4.43Å; I215-K217 HydrophobicContact CD1-CG 3.72Å; I215-K217 HydrophobicContact CG1-CG 4.14Å; I215-K217 PolarHBondContact O-N 2.93Å; K217-W219 PolarHBondContact O-N 3.15Å; K217-P231 WeakPolarHBondContact O-CB 3.37Å; K217-F232 VanDerWaalsContact C-CZ 3.41Å; K217-Y266 HydrophobicContact CD-CD2 3.81Å; K217-Y266 HydrophobicContact CD-CG 4.09Å; K217-I268 HydrophobicContact CD-CD1 4.34Å; K217-I268 HydrophobicContact CD-CG1 3.77Å; K217-I268 HydrophobicContact CG-CG1 4.46Å
218	E	98.3	Very high	97.4	Very high	15 Å²	15	43.5 Å²	43.5	7%	0.07	21%	0.211	C	C	.	.			trans	-54.1	134.3	169.7	-62.4	78.3	-177.3	0	0	110.2	T220 Y226 F232 R256 Y263	E218-T220 HydrophobicContact CB-CG2 4.46Å; E218-Y226 HydrophobicContact CB-CD2 3.99Å; E218-Y226 HydrophobicContact CB-CE2 4.34Å; E218-Y226 HydrophobicContact CG-CD2 4.02Å; E218-Y226 HydrophobicContact CG-CE2 4.18Å; E218-F232 HydrophobicContact CB-CE2 4.44Å; E218-F232 HydrophobicContact CG-CE2 3.95Å; E218-F232 HydrophobicContact CG-CZ 4.16Å; E218-R256 IonicContact OE1-CZ 3.46Å; E218-R256 IonicContact OE1-NH1 3.57Å; E218-R256 IonicContact OE1-NH2 2.86Å; E218-R256 PolarHBondContact OE1-NH2 2.83Å; E218-R256 IonicContact OE2-CZ 3.81Å; E218-R256 IonicContact OE2-NH1 3.79Å; E218-R256 PolarHBondContact OE2-NH1 3.31Å; E218-R256 IonicContact OE2-NH2 3.63Å; E218-Y263 HydrophobicContact CB-CE2 4.43Å; E218-Y263 HydrophobicContact CG-CD2 4.05Å; E218-Y263 HydrophobicContact CG-CE2 4.09Å
219	W	98	Very high	97.5	Very high	94 Å²	94	40.7 Å²	40.7	36%	0.356	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	131.7	167.5	-167.7	-94.4	0	0	0	108.5	I215 K217 V227 N228 P231	I215-W219 HydrophobicContact CD1-CE3 4.27Å; I215-W219 HydrophobicContact CD1-CZ3 4.41Å; K217-W219 PolarHBondContact O-N 3.15Å; W219-V227 PolarHBondContact O-N 3.06Å; W219-N228 WeakPolarHBondContact CB-OD1 3.33Å; W219-N228 PolarHBondContact N-O 3.36Å; W219-P231 HydrophobicContact CB-CG 3.85Å; W219-P231 HydrophobicContact CD2-CG 4.38Å; W219-P231 HydrophobicContact CE3-CG 3.66Å
220	T	98	Very high	97.5	Very high	18 Å²	18	38.2 Å²	38.2	11%	0.11	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	162.3	-176.6	58.9	0	0	0	0	111.5	E218 R225 Y293	E218-T220 HydrophobicContact CB-CG2 4.46Å; T220-R225 CarbonylContact C-O 3.51Å; T220-R225 WeakPolarHBondContact CA-O 3.49Å; T220-R225 VanDerWaalsContact CB-O 3.3Å; T220-R225 WeakPolarHBondContact CB-O 3.3Å; T220-Y293 WeakPolarHBondContact OG1-CD1 3.43Å
221	T	97.1	Very high	97.5	Very high	51 Å²	51	38.4 Å²	38.4	31%	0.313	19%	0.187	S	C	.	.			trans	-62.3	168.8	158.6	57.1	0	0	0	0	110.7	D223 G224 R225 V227	T221-D223 WeakPolarHBondContact CB-OD1 3.16Å; T221-D223 PolarHBondContact O-N 2.97Å; T221-D223 VanDerWaalsContact O-N 3.1Å; T221-D223 PolarHBondContact OG1-OD1 3Å; T221-G224 PolarHBondContact O-N 3.15Å; T221-R225 HydrophobicContact CG2-CB 4.31Å; T221-R225 PolarHBondContact N-O 2.93Å; T221-R225 WeakPolarHBondContact OG1-CB 3.17Å; T221-R225 PolarHBondContact OG1-N 3.36Å; T221-V227 HydrophobicContact CG2-CG2 4.14Å
222	V	94.4	Very high	97.5	Very high	92 Å²	92	38.3 Å²	38.3	56%	0.558	19%	0.187	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-22.1	177.3	-61.2	0	0	0	0	113.7	E295	V222-E295 PolarHBondContact O-N 3.35Å
223	D	93.2	Very high	97.5	Very high	64 Å²	64	40.7 Å²	40.7	34%	0.342	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-105.1	17.1	176	70	-25.1	0	0	0	114	T221 R225 Y293	T221-D223 WeakPolarHBondContact CB-OD1 3.16Å; T221-D223 PolarHBondContact O-N 2.97Å; T221-D223 VanDerWaalsContact O-N 3.1Å; T221-D223 PolarHBondContact OG1-OD1 3Å; D223-R225 IonicContact OD1-CZ 3.73Å; D223-R225 IonicContact OD1-NH1 3.78Å; D223-R225 PolarHBondContact OD1-NH1 2.57Å; D223-R225 VanDerWaalsContact OD1-NH1 3.08Å; D223-R225 IonicContact OD2-CZ 3.5Å; D223-R225 IonicContact OD2-NE 3.87Å; D223-R225 IonicContact OD2-NH1 3.47Å; D223-R225 PolarHBondContact OD2-NH1 3.04Å; D223-R225 IonicContact OD2-NH2 2.8Å; D223-R225 PolarHBondContact OD2-NH2 3.15Å; D223-Y293 CarbonylContact C-O 3.54Å
224	G	95.8	Very high	97.5	Very high	1 Å²	1	40.7 Å²	40.7	1%	0.01	20%	0.196	C	C	.	.			trans	82.2	17	166.9	0	0	0	0	0	115.9	T221 Y293	T221-G224 PolarHBondContact O-N 3.15Å; G224-Y293 VanDerWaalsContact CA-O 3.3Å; G224-Y293 WeakPolarHBondContact CA-O 3.32Å; G224-Y293 PolarHBondContact N-O 3.21Å
225	R	97	Very high	97.5	Very high	159 Å²	159	40.7 Å²	40.7	60%	0.6	20%	0.196	S	C	*	.			trans	-78.5	131	171.1	-57.9	-167.8	-174.1	80.5	15.7	110	T220 T221 D223	T220-R225 CarbonylContact C-O 3.51Å; T220-R225 WeakPolarHBondContact CA-O 3.49Å; T220-R225 VanDerWaalsContact CB-O 3.3Å; T220-R225 WeakPolarHBondContact CB-O 3.3Å; T221-R225 HydrophobicContact CG2-CB 4.31Å; T221-R225 PolarHBondContact N-O 2.93Å; T221-R225 WeakPolarHBondContact OG1-CB 3.17Å; T221-R225 PolarHBondContact OG1-N 3.36Å; D223-R225 IonicContact OD1-CZ 3.73Å; D223-R225 IonicContact OD1-NH1 3.78Å; D223-R225 PolarHBondContact OD1-NH1 2.57Å; D223-R225 VanDerWaalsContact OD1-NH1 3.08Å; D223-R225 IonicContact OD2-CZ 3.5Å; D223-R225 IonicContact OD2-NE 3.87Å; D223-R225 IonicContact OD2-NH1 3.47Å; D223-R225 PolarHBondContact OD2-NH1 3.04Å; D223-R225 IonicContact OD2-NH2 2.8Å; D223-R225 PolarHBondContact OD2-NH2 3.15Å
226	Y	98.1	Very high	97.6	Very high	114 Å²	114	40.4 Å²	40.4	45%	0.447	19%	0.194	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-55.1	141	177.3	175.2	-92.5	0	0	0	112.6	E218 D229	E218-Y226 HydrophobicContact CB-CD2 3.99Å; E218-Y226 HydrophobicContact CB-CE2 4.34Å; E218-Y226 HydrophobicContact CG-CD2 4.02Å; E218-Y226 HydrophobicContact CG-CE2 4.18Å; Y226-D229 PolarHBondContact OH-OD2 2.84Å
227	V	97.9	Very high	97.6	Very high	77 Å²	77	40.2 Å²	40.2	47%	0.467	19%	0.193	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	-55.7	173.8	178.3	0	0	0	0	110.9	W219 T221	W219-V227 PolarHBondContact O-N 3.06Å; T221-V227 HydrophobicContact CG2-CG2 4.14Å
228	N	97.5	Very high	97.5	Very high	35 Å²	35	41.7 Å²	41.7	19%	0.187	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.5	-178.1	179.5	72.1	42	0	0	0	112.6	W219 D230	W219-N228 WeakPolarHBondContact CB-OD1 3.33Å; W219-N228 PolarHBondContact N-O 3.36Å; N228-D230 VanDerWaalsContact CG-CG 3.41Å; N228-D230 VanDerWaalsContact CG-OD2 3.31Å; N228-D230 PolarHBondContact ND2-OD2 3.29Å; N228-D230 WeakPolarHBondContact OD1-CB 3.44Å; N228-D230 PolarHBondContact OD1-N 2.64Å; N228-D230 PolarHBondContact OD1-OD2 2.94Å
229	D	97.9	Very high	97.3	Very high	38 Å²	38	45.2 Å²	45.2	20%	0.203	22%	0.22	C	C	.	.			trans	-112.2	12.8	-178.7	-73	-39.4	0	0	0	113.7	Y226 P231 F232 K249	Y226-D229 PolarHBondContact OH-OD2 2.84Å; D229-P231 VanDerWaalsContact C-N 3.27Å; D229-F232 HydrophobicContact CB-CD2 3.77Å; D229-F232 HydrophobicContact CB-CE2 4.33Å; D229-F232 WeakPolarHBondContact O-CB 3.43Å; D229-F232 WeakPolarHBondContact O-CD2 3.48Å; D229-F232 PolarHBondContact O-N 2.94Å; D229-F232 VanDerWaalsContact O-N 3.08Å; D229-F232 VanDerWaalsContact OD1-CE2 3.29Å; D229-F232 WeakPolarHBondContact OD1-CE2 3.43Å; D229-K249 IonicContact OD1-NZ 2.82Å; D229-K249 PolarHBondContact OD1-NZ 2.84Å; D229-K249 IonicContact OD2-NZ 2.66Å; D229-K249 PolarHBondContact OD2-NZ 2.95Å
230	D	98.4	Very high	97.2	Very high	15 Å²	15	47.4 Å²	47.4	8%	0.08	24%	0.236	C	C	.	.	G	3₁₀ helix	trans	-52.1	-37.8	-178.3	-57	-14.9	0	0	0	113.4	H194 K196 N228 F232 W233	H194-D230 IonicContact CE1-OD1 3.65Å; H194-D230 IonicContact CE1-OD2 2.82Å; H194-D230 IonicContact NE2-OD1 3.71Å; K196-D230 IonicContact NZ-OD2 3.69Å; K196-D230 PolarHBondContact NZ-OD2 2.91Å; N228-D230 VanDerWaalsContact CG-CG 3.41Å; N228-D230 VanDerWaalsContact CG-OD2 3.31Å; N228-D230 PolarHBondContact ND2-OD2 3.29Å; N228-D230 WeakPolarHBondContact OD1-CB 3.44Å; N228-D230 PolarHBondContact OD1-N 2.64Å; N228-D230 PolarHBondContact OD1-OD2 2.94Å; D230-F232 PolarHBondContact O-N 2.78Å; D230-F232 VanDerWaalsContact O-N 3.13Å; D230-W233 WeakPolarHBondContact O-CB 3.28Å; D230-W233 VanDerWaalsContact O-CD1 3.28Å; D230-W233 PolarHBondContact O-N 2.72Å; D230-W233 VanDerWaalsContact O-N 3.13Å
231	P	98.4	Very high	97.1	Very high	5 Å²	5	47.4 Å²	47.4	3%	0.032	24%	0.239	C	C	.	.	G	3₁₀ helix	trans	-72.9	-4.4	-177.8	-14.6	29.3	0	0	0	115.5	I215 G216 K217 W219 D229 W233	I215-P231 HydrophobicContact CD1-CB 3.96Å; I215-P231 HydrophobicContact CD1-CG 4.16Å; I215-P231 HydrophobicContact CG1-CB 3.36Å; I215-P231 HydrophobicContact CG1-CG 4.1Å; G216-P231 PolarHBondContact N-O 3.34Å; G216-P231 VanDerWaalsContact N-O 3.12Å; K217-P231 WeakPolarHBondContact O-CB 3.37Å; W219-P231 HydrophobicContact CB-CG 3.85Å; W219-P231 HydrophobicContact CD2-CG 4.38Å; W219-P231 HydrophobicContact CE3-CG 3.66Å; D229-P231 VanDerWaalsContact C-N 3.27Å; P231-W233 VanDerWaalsContact C-N 3.28Å
232	F	98.5	Very high	97.1	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	25%	0.252	C	S	.	.	G	3₁₀ helix	trans	-82.5	-5.5	171.5	-69.2	-69.1	0	0	0	113.2	G216 K217 E218 D229 D230 W248 K249 Y252	G216-F232 WeakPolarHBondContact O-CE1 3.47Å; K217-F232 VanDerWaalsContact C-CZ 3.41Å; E218-F232 HydrophobicContact CB-CE2 4.44Å; E218-F232 HydrophobicContact CG-CE2 3.95Å; E218-F232 HydrophobicContact CG-CZ 4.16Å; D229-F232 HydrophobicContact CB-CD2 3.77Å; D229-F232 HydrophobicContact CB-CE2 4.33Å; D229-F232 WeakPolarHBondContact O-CB 3.43Å; D229-F232 WeakPolarHBondContact O-CD2 3.48Å; D229-F232 PolarHBondContact O-N 2.94Å; D229-F232 VanDerWaalsContact O-N 3.08Å; D229-F232 VanDerWaalsContact OD1-CE2 3.29Å; D229-F232 WeakPolarHBondContact OD1-CE2 3.43Å; D230-F232 PolarHBondContact O-N 2.78Å; D230-F232 VanDerWaalsContact O-N 3.13Å; F232-W248 WeakPolarHBondContact O-CA 3.24Å; F232-W248 WeakPolarHBondContact O-CB 3.45Å; F232-W248 PolarHBondContact O-N 3.4Å; F232-K249 HydrophobicContact CB-CB 3.81Å; F232-K249 HydrophobicContact CB-CG 4.42Å; F232-K249 HydrophobicContact CD1-CB 4.11Å; F232-K249 HydrophobicContact CD1-CG 4.06Å; F232-K249 HydrophobicContact CD2-CB 4.28Å; F232-K249 HydrophobicContact CD2-CD 3.93Å; F232-K249 HydrophobicContact CD2-CG 3.98Å; F232-K249 HydrophobicContact CE1-CG 4.22Å; F232-K249 HydrophobicContact CE2-CD 4.07Å; F232-K249 HydrophobicContact CE2-CG 4.16Å; F232-K249 HydrophobicContact CG-CB 3.83Å; F232-K249 HydrophobicContact CG-CD 4.34Å; F232-K249 HydrophobicContact CG-CG 3.91Å; F232-K249 HydrophobicContact CZ-CG 4.26Å; F232-Y252 HydrophobicContact CB-CD2 4.45Å; F232-Y252 AromaticContact CD1-CD2 3.78Å; F232-Y252 HydrophobicContact CD1-CD2 3.78Å; F232-Y252 HydrophobicContact CD1-CG 4.11Å
233	W	98.5	Very high	97.2	Very high	49 Å²	49	48.7 Å²	48.7	19%	0.186	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	147.9	179.6	-73.5	79.9	0	0	0	112	G190 D191 F198 D230 P231 H245 V246 N247	G190-W233 VanDerWaalsContact C-CD2 3.44Å; G190-W233 WeakPolarHBondContact O-CB 3.42Å; G190-W233 VanDerWaalsContact O-CG 3.31Å; D191-W233 HydrophobicContact CB-CD2 4.39Å; D191-W233 HydrophobicContact CB-CE3 4.36Å; D191-W233 HydrophobicContact CB-CH2 3.36Å; D191-W233 HydrophobicContact CB-CZ2 3.38Å; D191-W233 HydrophobicContact CB-CZ3 3.88Å; F198-W233 HydrophobicContact CE2-CB 4.46Å; F198-W233 WeakPolarHBondContact CZ-O 3.28Å; D230-W233 WeakPolarHBondContact O-CB 3.28Å; D230-W233 VanDerWaalsContact O-CD1 3.28Å; D230-W233 PolarHBondContact O-N 2.72Å; D230-W233 VanDerWaalsContact O-N 3.13Å; P231-W233 VanDerWaalsContact C-N 3.28Å; W233-H245 HydrophobicContact CE3-CB 3.92Å; W233-H245 HydrophobicContact CZ3-CB 3.89Å; W233-V246 WeakPolarHBondContact CA-O 3.2Å; W233-N247 HydrophobicContact CD2-CB 4.14Å; W233-N247 HydrophobicContact CE3-CB 4.24Å; W233-N247 HydrophobicContact CH2-CB 4.08Å; W233-N247 HydrophobicContact CZ2-CB 3.95Å; W233-N247 HydrophobicContact CZ3-CB 4.22Å
234	V	98.7	Very high	97.4	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	140	173.7	171.7	0	0	0	0	108.9	W202 Y211 I212 I236 V246 W248 Y252	W202-V234 HydrophobicContact CH2-CG1 4.14Å; W202-V234 HydrophobicContact CH2-CG2 3.98Å; W202-V234 HydrophobicContact CZ2-CG2 3.89Å; Y211-V234 HydrophobicContact CD1-CG1 4.05Å; I212-V234 CarbonylContact O-C 3.59Å; I212-V234 WeakPolarHBondContact O-CA 3.36Å; V234-I236 HydrophobicContact CG1-CG1 4.45Å; V234-V246 PolarHBondContact N-O 2.9Å; V234-V246 PolarHBondContact O-N 3.46Å; V234-W248 HydrophobicContact CB-CD2 3.99Å; V234-W248 HydrophobicContact CB-CG 3.97Å; V234-W248 HydrophobicContact CG1-CD2 4.4Å; V234-W248 HydrophobicContact CG1-CZ2 4.17Å; V234-W248 HydrophobicContact CG2-CB 3.88Å; V234-W248 HydrophobicContact CG2-CD2 3.44Å; V234-W248 VanDerWaalsContact CG2-CD2 3.44Å; V234-W248 HydrophobicContact CG2-CE3 3.66Å; V234-W248 HydrophobicContact CG2-CG 3.54Å; V234-W248 HydrophobicContact CG2-CZ3 4.3Å; V234-Y252 HydrophobicContact CG2-CE2 4.34Å
235	K	98.6	Very high	97.5	Very high	0 Å²	0	53.7 Å²	53.7	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	129	176.8	-49.3	-59.7	-173.1	-96	0	108.3	L187 A188 G190 F198 Y211 I212 V243 K244 H245	L187-K235 HydrophobicContact CB-CG 4.39Å; L187-K235 HydrophobicContact CD1-CB 4.31Å; L187-K235 HydrophobicContact CD1-CG 4.17Å; L187-K235 HydrophobicContact CD2-CB 4.11Å; L187-K235 HydrophobicContact CD2-CG 4.26Å; A188-K235 WeakPolarHBondContact O-CE 3.38Å; G190-K235 PolarHBondContact O-NZ 3.36Å; F198-K235 HydrophobicContact CD1-CD 4.49Å; F198-K235 HydrophobicContact CD1-CG 3.61Å; F198-K235 HydrophobicContact CE1-CG 3.62Å; F198-K235 VanDerWaalsContact CE2-NZ 3.27Å; F198-K235 HydrophobicContact CG-CG 4.15Å; F198-K235 HydrophobicContact CZ-CG 4.16Å; Y211-K235 CarbonylContact C-O 3.56Å; Y211-K235 WeakPolarHBondContact CA-O 3.33Å; I212-K235 HydrophobicContact CB-CB 4.33Å; I212-K235 HydrophobicContact CD1-CB 4.35Å; I212-K235 PolarHBondContact N-O 3.38Å; I212-K235 PolarHBondContact O-N 2.97Å; K235-V243 HydrophobicContact CB-CG1 4.27Å; K235-V243 HydrophobicContact CD-CG1 4.46Å; K235-K244 CarbonylContact C-O 3.43Å; K235-K244 WeakPolarHBondContact CA-O 3.25Å; K235-H245 VanDerWaalsContact CD-ND1 3.27Å; K235-H245 WeakPolarHBondContact CD-ND1 3.16Å; K235-H245 VanDerWaalsContact CE-ND1 3.3Å; K235-H245 WeakPolarHBondContact CE-ND1 3.32Å
236	I	98.3	Very high	97.5	Very high	7 Å²	7	46.6 Å²	46.6	4%	0.036	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	116.9	177.8	-51.7	176.8	0	0	0	107.3	K209 L210 Y211 V234 K244 V246	K209-I236 HydrophobicContact CB-CG2 3.8Å; K209-I236 HydrophobicContact CD-CG2 3.63Å; K209-I236 HydrophobicContact CG-CG2 4.25Å; L210-I236 CarbonylContact O-C 3.59Å; L210-I236 WeakPolarHBondContact O-CA 3.22Å; Y211-I236 HydrophobicContact CD1-CD1 4.06Å; Y211-I236 HydrophobicContact CD1-CG1 3.76Å; Y211-I236 HydrophobicContact CD2-CG2 4.49Å; Y211-I236 HydrophobicContact CE1-CD1 3.42Å; Y211-I236 VanDerWaalsContact CE1-CD1 3.42Å; Y211-I236 HydrophobicContact CE1-CG1 3.64Å; Y211-I236 HydrophobicContact CE1-CG2 4.32Å; Y211-I236 HydrophobicContact CE2-CG2 4.13Å; Y211-I236 HydrophobicContact CG-CG1 4.42Å; V234-I236 HydrophobicContact CG1-CG1 4.45Å; I236-K244 HydrophobicContact CB-CB 4.35Å; I236-K244 PolarHBondContact N-O 3.49Å; I236-K244 PolarHBondContact O-N 2.67Å; I236-V246 HydrophobicContact CD1-CB 4.45Å; I236-V246 HydrophobicContact CD1-CG2 3.62Å; I236-V246 HydrophobicContact CG1-CG2 4.27Å
237	V	98.3	Very high	97.5	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	125.6	-176.7	-176.7	0	0	0	0	109.2	I172 W184 I185 L187 K209 L210 I212 H242 V243	I172-V237 HydrophobicContact CD1-CG2 4.21Å; W184-V237 HydrophobicContact CH2-CG1 4.01Å; W184-V237 HydrophobicContact CZ3-CG1 4.4Å; I185-V237 HydrophobicContact CD1-CG1 3.49Å; I185-V237 VanDerWaalsContact CD1-CG1 3.49Å; L187-V237 HydrophobicContact CD2-CG2 4.27Å; K209-V237 WeakPolarHBondContact CA-O 3.44Å; L210-V237 HydrophobicContact CB-CB 4.29Å; L210-V237 PolarHBondContact N-O 3.16Å; L210-V237 PolarHBondContact O-N 2.68Å; I212-V237 HydrophobicContact CD1-CB 4.34Å; I212-V237 HydrophobicContact CD1-CG2 3.62Å; V237-H242 WeakPolarHBondContact CA-O 3.35Å; V237-V243 HydrophobicContact CG2-CG2 4.22Å
238	D	96.8	Very high	97.5	Very high	41 Å²	41	40.9 Å²	40.9	22%	0.219	21%	0.207	C	C	.	.			trans	-84.8	176.6	174	72.6	13.7	0	0	0	112.4	M240 G241 H242	D238-M240 PolarHBondContact O-N 2.81Å; D238-M240 WeakPolarHBondContact OD1-CA 3.24Å; D238-M240 WeakPolarHBondContact OD1-CB 3.33Å; D238-M240 PolarHBondContact OD1-N 3.2Å; D238-G241 PolarHBondContact O-N 3.04Å; D238-G241 PolarHBondContact OD1-N 2.94Å; D238-H242 PolarHBondContact N-O 2.85Å; D238-H242 IonicContact OD1-CG 3.96Å; D238-H242 PolarHBondContact OD1-N 3.2Å; D238-H242 IonicContact OD1-ND1 2.61Å; D238-H242 PolarHBondContact OD1-ND1 2.64Å; D238-H242 WeakPolarHBondContact OD2-CB 3.3Å; D238-H242 IonicContact OD2-CE1 2.93Å; D238-H242 IonicContact OD2-CG 3.08Å; D238-H242 IonicContact OD2-ND1 3.85Å; D238-H242 PolarHBondContact OD2-ND1 2.59Å
239	N	94.4	Very high	97.5	Very high	89 Å²	89	41.7 Å²	41.7	48%	0.476	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-18.9	179.7	61.6	0.9	0	0	0	114.2	N159	N159-N239 PolarHBondContact ND2-O 2.91Å
240	M	94.7	Very high	97.4	Very high	141 Å²	141	44.2 Å²	44.2	70%	0.695	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89	-10.3	175.5	-63.5	-55.4	-58.9	0	0	112.4	D238	D238-M240 PolarHBondContact O-N 2.81Å; D238-M240 WeakPolarHBondContact OD1-CA 3.24Å; D238-M240 WeakPolarHBondContact OD1-CB 3.33Å; D238-M240 PolarHBondContact OD1-N 3.2Å
241	G	95.7	Very high	97.4	Very high	17 Å²	17	43.5 Å²	43.5	18%	0.175	22%	0.217	C	C	.	.			trans	87.6	14.7	-178.8	0	0	0	0	0	114.6	I185 D238	I185-G241 VanDerWaalsContact CD1-CA 3.4Å; D238-G241 PolarHBondContact O-N 3.04Å; D238-G241 PolarHBondContact OD1-N 2.94Å
242	H	97.2	Very high	97.4	Very high	124 Å²	124	43.3 Å²	43.3	57%	0.574	22%	0.216	S	C	*	.			trans	-71.3	133.3	171.6	-54.3	119.1	0	0	0	110.1	V237 D238	V237-H242 WeakPolarHBondContact CA-O 3.35Å; D238-H242 PolarHBondContact N-O 2.85Å; D238-H242 IonicContact OD1-CG 3.96Å; D238-H242 PolarHBondContact OD1-N 3.2Å; D238-H242 IonicContact OD1-ND1 2.61Å; D238-H242 PolarHBondContact OD1-ND1 2.64Å; D238-H242 WeakPolarHBondContact OD2-CB 3.3Å; D238-H242 IonicContact OD2-CE1 2.93Å; D238-H242 IonicContact OD2-CG 3.08Å; D238-H242 IonicContact OD2-ND1 3.85Å; D238-H242 PolarHBondContact OD2-ND1 2.59Å
243	V	97.9	Very high	97.4	Very high	47 Å²	47	45.9 Å²	45.9	29%	0.285	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	125.4	-178.7	-171.8	0	0	0	0	109.8	I185 L187 K235 V237	I185-V243 HydrophobicContact CG2-CG2 3.59Å; L187-V243 HydrophobicContact CD2-CG1 3.87Å; L187-V243 HydrophobicContact CD2-CG2 4.04Å; K235-V243 HydrophobicContact CB-CG1 4.27Å; K235-V243 HydrophobicContact CD-CG1 4.46Å; V237-V243 HydrophobicContact CG2-CG2 4.22Å
244	K	97.4	Very high	97.4	Very high	114 Å²	114	46.4 Å²	46.4	50%	0.496	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	134.2	167.5	-178.4	-180	178.7	179.1	0	109.8	K235 I236 V246	K235-K244 CarbonylContact C-O 3.43Å; K235-K244 WeakPolarHBondContact CA-O 3.25Å; I236-K244 HydrophobicContact CB-CB 4.35Å; I236-K244 PolarHBondContact N-O 3.49Å; I236-K244 PolarHBondContact O-N 2.67Å; K244-V246 HydrophobicContact CD-CG2 4.15Å; K244-V246 HydrophobicContact CG-CG2 3.98Å
245	H	97.6	Very high	97.4	Very high	56 Å²	56	46.4 Å²	46.4	26%	0.259	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	126.2	178.1	-52.9	-98.4	0	0	0	109.2	G192 W233 K235	G192-H245 WeakPolarHBondContact CA-CE1 3.38Å; G192-H245 WeakPolarHBondContact CA-ND1 3.49Å; G192-H245 PolarHBondContact N-ND1 2.81Å; W233-H245 HydrophobicContact CE3-CB 3.92Å; W233-H245 HydrophobicContact CZ3-CB 3.89Å; K235-H245 VanDerWaalsContact CD-ND1 3.27Å; K235-H245 WeakPolarHBondContact CD-ND1 3.16Å; K235-H245 VanDerWaalsContact CE-ND1 3.3Å; K235-H245 WeakPolarHBondContact CE-ND1 3.32Å
246	V	97.2	Very high	97.3	Very high	10 Å²	10	47 Å²	47	6%	0.061	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	131.6	-178.1	-170.5	0	0	0	0	110.5	L61 W233 V234 I236 K244 W248	L61-V246 WeakPolarHBondContact O-CG1 3.23Å; W233-V246 WeakPolarHBondContact CA-O 3.2Å; V234-V246 PolarHBondContact N-O 2.9Å; V234-V246 PolarHBondContact O-N 3.46Å; I236-V246 HydrophobicContact CD1-CB 4.45Å; I236-V246 HydrophobicContact CD1-CG2 3.62Å; I236-V246 HydrophobicContact CG1-CG2 4.27Å; K244-V246 HydrophobicContact CD-CG2 4.15Å; K244-V246 HydrophobicContact CG-CG2 3.98Å; V246-W248 PolarHBondContact O-N 3.48Å
247	N	96.6	Very high	97.3	Very high	70 Å²	70	53 Å²	53	37%	0.374	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	113	178.3	-173.8	-21.2	0	0	0	110.6	W233 K249	W233-N247 HydrophobicContact CD2-CB 4.14Å; W233-N247 HydrophobicContact CE3-CB 4.24Å; W233-N247 HydrophobicContact CH2-CB 4.08Å; W233-N247 HydrophobicContact CZ2-CB 3.95Å; W233-N247 HydrophobicContact CZ3-CB 4.22Å; N247-K249 WeakPolarHBondContact OD1-CB 3.16Å; N247-K249 PolarHBondContact OD1-N 2.77Å
248	W	98.1	Very high	97.3	Very high	0 Å²	0	54.9 Å²	54.9	0%	0	28%	0.279	C	S	.	.			trans	-99.2	14.9	-179.9	-83.9	33.4	0	0	0	113.5	Y62 W202 Y211 F232 V234 V246 I250 A251 Y252 W281 F283 F313	Y62-W248 AromaticContact CD1-CD1 3.78Å; Y62-W248 HydrophobicContact CD1-CD2 4.34Å; Y62-W248 HydrophobicContact CD1-CG 4.06Å; Y62-W248 AromaticContact CD1-NE1 3.88Å; Y62-W248 PolarHBondContact O-NE1 3.04Å; W202-W248 HydrophobicContact CH2-CE3 4.28Å; W202-W248 HydrophobicContact CH2-CH2 4.04Å; W202-W248 AromaticContact CH2-CZ3 3.65Å; W202-W248 HydrophobicContact CH2-CZ3 3.65Å; W202-W248 HydrophobicContact CZ2-CE3 4.33Å; W202-W248 HydrophobicContact CZ2-CZ3 4.04Å; Y211-W248 HydrophobicContact CD1-CH2 4.03Å; Y211-W248 AromaticContact CD1-CZ2 3.67Å; Y211-W248 HydrophobicContact CD1-CZ2 3.67Å; Y211-W248 HydrophobicContact CE1-CH2 4.48Å; Y211-W248 AromaticContact CE1-CZ2 3.83Å; Y211-W248 HydrophobicContact CE1-CZ2 3.83Å; F232-W248 WeakPolarHBondContact O-CA 3.24Å; F232-W248 WeakPolarHBondContact O-CB 3.45Å; F232-W248 PolarHBondContact O-N 3.4Å; V234-W248 HydrophobicContact CB-CD2 3.99Å; V234-W248 HydrophobicContact CB-CG 3.97Å; V234-W248 HydrophobicContact CG1-CD2 4.4Å; V234-W248 HydrophobicContact CG1-CZ2 4.17Å; V234-W248 HydrophobicContact CG2-CB 3.88Å; V234-W248 HydrophobicContact CG2-CD2 3.44Å; V234-W248 VanDerWaalsContact CG2-CD2 3.44Å; V234-W248 HydrophobicContact CG2-CE3 3.66Å; V234-W248 HydrophobicContact CG2-CG 3.54Å; V234-W248 HydrophobicContact CG2-CZ3 4.3Å; V246-W248 PolarHBondContact O-N 3.48Å; W248-I250 VanDerWaalsContact C-N 3.27Å; W248-I250 PolarHBondContact O-N 3.07Å; W248-I250 VanDerWaalsContact O-N 3.12Å; W248-A251 HydrophobicContact CB-CB 4.35Å; W248-A251 HydrophobicContact CE3-CB 4.4Å; W248-A251 WeakPolarHBondContact O-CA 3.5Å; W248-A251 WeakPolarHBondContact O-CB 3.47Å; W248-A251 PolarHBondContact O-N 3.3Å; W248-Y252 HydrophobicContact CB-CD2 3.82Å; W248-Y252 HydrophobicContact CB-CE2 3.71Å; W248-Y252 WeakPolarHBondContact O-CD2 3.29Å; W248-Y252 PolarHBondContact O-N 3.34Å; W248-Y252 VanDerWaalsContact O-N 3.07Å; W248-W281 HydrophobicContact CH2-CD2 4.42Å; W248-W281 AromaticContact CH2-CE2 3.82Å; W248-W281 AromaticContact CH2-CH2 3.85Å; W248-W281 HydrophobicContact CH2-CH2 3.85Å; W248-W281 AromaticContact CH2-CZ2 3.52Å; W248-W281 HydrophobicContact CH2-CZ2 3.52Å; W248-W281 HydrophobicContact CH2-CZ3 4.41Å; W248-W281 HydrophobicContact CZ2-CZ2 4.18Å; W248-F283 HydrophobicContact CZ3-CZ 4.22Å; W248-F313 HydrophobicContact CE3-CE2 4.43Å; W248-F313 HydrophobicContact CE3-CZ 4.11Å; W248-F313 HydrophobicContact CH2-CZ 4.33Å; W248-F313 HydrophobicContact CZ3-CE2 4.26Å; W248-F313 AromaticContact CZ3-CZ 3.78Å; W248-F313 HydrophobicContact CZ3-CZ 3.78Å
249	K	97.4	Very high	97.4	Very high	53 Å²	53	54.7 Å²	54.7	23%	0.23	28%	0.277	C	S	.	.	H	α-helix	trans	-48.1	-47.4	-177.5	-176.3	164.7	-179.3	163.1	0	112.8	D229 F232 N247 A251 Y252 L253	D229-K249 IonicContact OD1-NZ 2.82Å; D229-K249 PolarHBondContact OD1-NZ 2.84Å; D229-K249 IonicContact OD2-NZ 2.66Å; D229-K249 PolarHBondContact OD2-NZ 2.95Å; F232-K249 HydrophobicContact CB-CB 3.81Å; F232-K249 HydrophobicContact CB-CG 4.42Å; F232-K249 HydrophobicContact CD1-CB 4.11Å; F232-K249 HydrophobicContact CD1-CG 4.06Å; F232-K249 HydrophobicContact CD2-CB 4.28Å; F232-K249 HydrophobicContact CD2-CD 3.93Å; F232-K249 HydrophobicContact CD2-CG 3.98Å; F232-K249 HydrophobicContact CE1-CG 4.22Å; F232-K249 HydrophobicContact CE2-CD 4.07Å; F232-K249 HydrophobicContact CE2-CG 4.16Å; F232-K249 HydrophobicContact CG-CB 3.83Å; F232-K249 HydrophobicContact CG-CD 4.34Å; F232-K249 HydrophobicContact CG-CG 3.91Å; F232-K249 HydrophobicContact CZ-CG 4.26Å; N247-K249 WeakPolarHBondContact OD1-CB 3.16Å; N247-K249 PolarHBondContact OD1-N 2.77Å; K249-A251 VanDerWaalsContact C-N 3.33Å; K249-A251 PolarHBondContact O-N 2.99Å; K249-Y252 PolarHBondContact O-N 2.8Å; K249-L253 HydrophobicContact CG-CD1 4.05Å; K249-L253 HydrophobicContact CG-CG 4.3Å; K249-L253 WeakPolarHBondContact O-CB 3.26Å; K249-L253 WeakPolarHBondContact O-CG 3.36Å; K249-L253 PolarHBondContact O-N 2.72Å
250	I	96.8	Very high	97.6	Very high	90 Å²	90	52.9 Å²	52.9	46%	0.462	28%	0.28	S	S	.	.	H	α-helix	trans	-62.1	-38.8	178.4	-61.2	175.8	0	0	0	112	W248 K254	W248-I250 VanDerWaalsContact C-N 3.27Å; W248-I250 PolarHBondContact O-N 3.07Å; W248-I250 VanDerWaalsContact O-N 3.12Å; I250-K254 WeakPolarHBondContact O-CG 3.06Å; I250-K254 PolarHBondContact O-N 2.8Å
251	A	97.9	Very high	97.7	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-63.8	-50.6	177.5	0	0	0	0	0	111.4	Y62 W248 K249 L253 K254 L255 F313	Y62-A251 HydrophobicContact CD1-CB 4.22Å; Y62-A251 HydrophobicContact CE1-CB 3.46Å; Y62-A251 VanDerWaalsContact CE1-CB 3.46Å; Y62-A251 PolarHBondContact OH-N 2.03Å; W248-A251 HydrophobicContact CB-CB 4.35Å; W248-A251 HydrophobicContact CE3-CB 4.4Å; W248-A251 WeakPolarHBondContact O-CA 3.5Å; W248-A251 WeakPolarHBondContact O-CB 3.47Å; W248-A251 PolarHBondContact O-N 3.3Å; K249-A251 VanDerWaalsContact C-N 3.33Å; K249-A251 PolarHBondContact O-N 2.99Å; A251-L253 VanDerWaalsContact C-N 3.33Å; A251-L253 PolarHBondContact O-N 3.48Å; A251-K254 PolarHBondContact O-N 2.78Å; A251-L255 WeakPolarHBondContact O-CG 3.45Å; A251-L255 PolarHBondContact O-N 3.31Å; A251-F313 HydrophobicContact CB-CB 4.33Å; A251-F313 HydrophobicContact CB-CD1 3.8Å; A251-F313 HydrophobicContact CB-CD2 3.53Å; A251-F313 HydrophobicContact CB-CE1 3.9Å; A251-F313 HydrophobicContact CB-CE2 3.64Å; A251-F313 HydrophobicContact CB-CG 3.62Å; A251-F313 HydrophobicContact CB-CZ 3.83Å
252	Y	98.6	Very high	97.9	Very high	1 Å²	1	53.4 Å²	53.4	0%	0.004	28%	0.276	C	S	.	.	H	α-helix	trans	-61.9	-38.9	178.9	-72.2	-67.7	0	0	0	113	W202 G214 G216 F232 V234 W248 K249 K254 L255 R256 H269 F283	W202-Y252 WeakPolarHBondContact CZ2-OH 3.22Å; W202-Y252 PolarHBondContact NE1-OH 3.35Å; G214-Y252 PolarHBondContact O-OH 2.72Å; G216-Y252 VanDerWaalsContact CA-CD1 3.46Å; G216-Y252 VanDerWaalsContact CA-CE1 3.44Å; G216-Y252 WeakPolarHBondContact O-CB 3.47Å; F232-Y252 HydrophobicContact CB-CD2 4.45Å; F232-Y252 AromaticContact CD1-CD2 3.78Å; F232-Y252 HydrophobicContact CD1-CD2 3.78Å; F232-Y252 HydrophobicContact CD1-CG 4.11Å; V234-Y252 HydrophobicContact CG2-CE2 4.34Å; W248-Y252 HydrophobicContact CB-CD2 3.82Å; W248-Y252 HydrophobicContact CB-CE2 3.71Å; W248-Y252 WeakPolarHBondContact O-CD2 3.29Å; W248-Y252 PolarHBondContact O-N 3.34Å; W248-Y252 VanDerWaalsContact O-N 3.07Å; K249-Y252 PolarHBondContact O-N 2.8Å; Y252-K254 VanDerWaalsContact C-N 3.33Å; Y252-K254 PolarHBondContact O-N 3.2Å; Y252-L255 HydrophobicContact CD1-CD1 4.19Å; Y252-L255 WeakPolarHBondContact O-CB 3.38Å; Y252-L255 PolarHBondContact O-N 3.22Å; Y252-R256 PolarHBondContact O-N 3.11Å; Y252-H269 AromaticContact CD1-CD2 3.45Å; Y252-H269 VanDerWaalsContact CD1-CD2 3.45Å; Y252-H269 WeakPolarHBondContact CD1-CD2 3.48Å; Y252-H269 AromaticContact CD1-NE2 3.74Å; Y252-H269 HydrophobicContact CE1-CB 4.19Å; Y252-H269 AromaticContact CE1-CD2 3.68Å; Y252-F283 HydrophobicContact CE1-CE1 4.29Å
253	L	98.1	Very high	97.9	Very high	55 Å²	55	52.3 Å²	52.3	29%	0.288	27%	0.268	S	S	.	.	H	α-helix	trans	-59.7	-43.7	174.8	-71.2	-179.9	0	0	0	111.8	K249 A251 L255 R256 E257	K249-L253 HydrophobicContact CG-CD1 4.05Å; K249-L253 HydrophobicContact CG-CG 4.3Å; K249-L253 WeakPolarHBondContact O-CB 3.26Å; K249-L253 WeakPolarHBondContact O-CG 3.36Å; K249-L253 PolarHBondContact O-N 2.72Å; A251-L253 VanDerWaalsContact C-N 3.33Å; A251-L253 PolarHBondContact O-N 3.48Å; L253-L255 VanDerWaalsContact C-N 3.35Å; L253-L255 PolarHBondContact O-N 2.66Å; L253-R256 VanDerWaalsContact CD2-CZ 3.42Å; L253-R256 WeakPolarHBondContact O-CG 3.28Å; L253-R256 PolarHBondContact O-N 2.85Å; L253-E257 VanDerWaalsContact O-CB 3.26Å; L253-E257 WeakPolarHBondContact O-CB 3.39Å; L253-E257 PolarHBondContact O-N 3.01Å
254	K	98.2	Very high	97.8	Very high	60 Å²	60	52.6 Å²	52.6	26%	0.261	27%	0.271	S	S	.	.	H	α-helix	trans	-67.4	-34.1	177.6	-69.8	-175.6	-175	174.8	0	113.2	I250 A251 Y252 E257 A258 F313	I250-K254 WeakPolarHBondContact O-CG 3.06Å; I250-K254 PolarHBondContact O-N 2.8Å; A251-K254 PolarHBondContact O-N 2.78Å; Y252-K254 VanDerWaalsContact C-N 3.33Å; Y252-K254 PolarHBondContact O-N 3.2Å; K254-E257 PolarHBondContact O-N 2.9Å; K254-A258 PolarHBondContact O-N 3.35Å; K254-A258 VanDerWaalsContact O-N 3.11Å; K254-F313 HydrophobicContact CD-CB 4.21Å; K254-F313 WeakPolarHBondContact CD-O 3.46Å; K254-F313 WeakPolarHBondContact CE-O 3.44Å; K254-F313 PolarHBondContact NZ-O 2.87Å
255	L	98.7	Very high	97.9	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-60.1	-47.6	175	-71.8	174.3	0	0	0	111.2	A251 Y252 L253 A258 F283 L307 A309 F313 V316	A251-L255 WeakPolarHBondContact O-CG 3.45Å; A251-L255 PolarHBondContact O-N 3.31Å; Y252-L255 HydrophobicContact CD1-CD1 4.19Å; Y252-L255 WeakPolarHBondContact O-CB 3.38Å; Y252-L255 PolarHBondContact O-N 3.22Å; L253-L255 VanDerWaalsContact C-N 3.35Å; L253-L255 PolarHBondContact O-N 2.66Å; L255-A258 WeakPolarHBondContact O-CB 3.47Å; L255-F283 HydrophobicContact CD1-CD1 4.04Å; L255-F283 HydrophobicContact CD1-CD2 3.76Å; L255-F283 HydrophobicContact CD1-CE1 4.04Å; L255-F283 HydrophobicContact CD1-CE2 3.78Å; L255-F283 HydrophobicContact CD1-CG 3.9Å; L255-F283 HydrophobicContact CD1-CZ 3.92Å; L255-F283 HydrophobicContact CD2-CD2 4.02Å; L255-F283 HydrophobicContact CD2-CE2 4.45Å; L255-L307 HydrophobicContact CB-CD1 3.91Å; L255-L307 HydrophobicContact CD2-CB 4.07Å; L255-L307 HydrophobicContact CD2-CD1 4.03Å; L255-L307 HydrophobicContact CG-CD1 4.49Å; L255-A309 HydrophobicContact CD2-CB 4.34Å; L255-F313 HydrophobicContact CD1-CE1 4.15Å; L255-F313 HydrophobicContact CD2-CD1 4.13Å; L255-F313 HydrophobicContact CD2-CE1 4.2Å; L255-F313 HydrophobicContact CG-CD1 4.19Å; L255-F313 HydrophobicContact CG-CE1 4.24Å; L255-V316 HydrophobicContact CD2-CG1 4.09Å; L255-V316 HydrophobicContact CD2-CG2 4.37Å
256	R	98.1	Very high	97.9	Very high	11 Å²	11	44.8 Å²	44.8	4%	0.042	24%	0.236	C	C	.	.	H	α-helix	trans	-75.4	-31.7	178.6	72.8	177.1	-171.5	-164.5	-1.1	113.4	E218 Y252 L253 A258 I259 G260 I261 G265 M267	E218-R256 IonicContact OE1-CZ 3.46Å; E218-R256 IonicContact OE1-NH1 3.57Å; E218-R256 IonicContact OE1-NH2 2.86Å; E218-R256 PolarHBondContact OE1-NH2 2.83Å; E218-R256 IonicContact OE2-CZ 3.81Å; E218-R256 IonicContact OE2-NH1 3.79Å; E218-R256 PolarHBondContact OE2-NH1 3.31Å; E218-R256 IonicContact OE2-NH2 3.63Å; Y252-R256 PolarHBondContact O-N 3.11Å; L253-R256 VanDerWaalsContact CD2-CZ 3.42Å; L253-R256 WeakPolarHBondContact O-CG 3.28Å; L253-R256 PolarHBondContact O-N 2.85Å; R256-A258 PolarHBondContact O-N 2.96Å; R256-I259 WeakPolarHBondContact O-CG1 3.43Å; R256-I259 PolarHBondContact O-N 2.84Å; R256-G260 PolarHBondContact O-N 3.39Å; R256-I261 HydrophobicContact CB-CB 4.1Å; R256-I261 HydrophobicContact CB-CG2 4.28Å; R256-I261 HydrophobicContact CG-CG2 4.46Å; R256-I261 PolarHBondContact O-N 3.45Å; R256-I261 VanDerWaalsContact O-N 3.09Å; R256-G265 PolarHBondContact NH1-O 2.79Å; R256-M267 HydrophobicContact CB-CB 3.83Å; R256-M267 HydrophobicContact CB-CE 4.07Å; R256-M267 HydrophobicContact CB-SD 4.12Å
257	E	98.2	Very high	98	Very high	133 Å²	133	44.3 Å²	44.3	62%	0.621	23%	0.233	S	C	*	.	H	α-helix	trans	-59.9	-35.2	173.4	-176.6	-178.2	-177.9	0	0	111.9	L253 K254 I259 G260	L253-E257 VanDerWaalsContact O-CB 3.26Å; L253-E257 WeakPolarHBondContact O-CB 3.39Å; L253-E257 PolarHBondContact O-N 3.01Å; K254-E257 PolarHBondContact O-N 2.9Å; E257-I259 PolarHBondContact O-N 3.43Å; E257-G260 PolarHBondContact O-N 2.84Å
258	A	98.3	Very high	98.1	Very high	41 Å²	41	41.6 Å²	41.6	34%	0.339	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-20.5	178.9	0	0	0	0	0	114.1	K254 L255 R256 V316 V318	K254-A258 PolarHBondContact O-N 3.35Å; K254-A258 VanDerWaalsContact O-N 3.11Å; L255-A258 WeakPolarHBondContact O-CB 3.47Å; R256-A258 PolarHBondContact O-N 2.96Å; A258-V316 HydrophobicContact CB-CB 3.74Å; A258-V316 HydrophobicContact CB-CG1 3.59Å; A258-V318 HydrophobicContact CB-CG2 3.98Å
259	I	97.7	Very high	98.1	Very high	36 Å²	36	41.6 Å²	41.6	19%	0.185	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-116.3	19.4	173.9	64.8	166.1	0	0	0	113	R256 E257 I261 M267 A288 V305 L307 V318	R256-I259 WeakPolarHBondContact O-CG1 3.43Å; R256-I259 PolarHBondContact O-N 2.84Å; E257-I259 PolarHBondContact O-N 3.43Å; I259-I261 HydrophobicContact CD1-CD1 3.63Å; I259-I261 HydrophobicContact CD1-CG1 4.34Å; I259-I261 HydrophobicContact CG1-CD1 3.88Å; I259-I261 HydrophobicContact CG1-CG1 4.09Å; I259-M267 HydrophobicContact CD1-CE 3.21Å; I259-M267 HydrophobicContact CG1-CE 3.65Å; I259-A288 HydrophobicContact CD1-CB 4.29Å; I259-V305 HydrophobicContact CG2-CG1 4.42Å; I259-L307 HydrophobicContact CG2-CD2 4.32Å; I259-V318 HydrophobicContact CG2-CB 4.45Å; I259-V318 HydrophobicContact CG2-CG1 3.71Å; I259-V318 HydrophobicContact CG2-CG2 3.84Å
260	G	98.2	Very high	98.2	Very high	51 Å²	51	39.9 Å²	39.9	53%	0.526	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	68.8	36.1	174.5	0	0	0	0	0	113.8	R256 E257	R256-G260 PolarHBondContact O-N 3.39Å; E257-G260 PolarHBondContact O-N 2.84Å
261	I	98.7	Very high	98.3	Very high	10 Å²	10	35.7 Å²	35.7	5%	0.051	19%	0.19	C	C	.	.			trans	-103.7	126.6	172.5	-63.9	174.7	0	0	0	109.2	R256 I259 M267 A288 S289 K290	R256-I261 HydrophobicContact CB-CB 4.1Å; R256-I261 HydrophobicContact CB-CG2 4.28Å; R256-I261 HydrophobicContact CG-CG2 4.46Å; R256-I261 PolarHBondContact O-N 3.45Å; R256-I261 VanDerWaalsContact O-N 3.09Å; I259-I261 HydrophobicContact CD1-CD1 3.63Å; I259-I261 HydrophobicContact CD1-CG1 4.34Å; I259-I261 HydrophobicContact CG1-CD1 3.88Å; I259-I261 HydrophobicContact CG1-CG1 4.09Å; I261-M267 HydrophobicContact CD1-CE 4.36Å; I261-A288 HydrophobicContact CD1-CB 3.73Å; I261-S289 WeakPolarHBondContact CG2-O 3.48Å; I261-K290 HydrophobicContact CG1-CG 4.02Å
262	E	98	Very high	98.3	Very high	160 Å²	160	35.7 Å²	35.7	75%	0.748	19%	0.19	S	C	*	.			trans	-125	158.9	171	62.5	-177.8	175.3	0	0	109.8	G265	E262-G265 WeakPolarHBondContact O-CA 3.33Å; E262-G265 PolarHBondContact O-N 2.76Å
263	Y	97.9	Very high	98.3	Very high	100 Å²	100	35.8 Å²	35.8	39%	0.392	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.6	133.9	173.9	-176.7	-93.5	0	0	0	110	E218	E218-Y263 HydrophobicContact CB-CE2 4.43Å; E218-Y263 HydrophobicContact CG-CD2 4.05Å; E218-Y263 HydrophobicContact CG-CE2 4.09Å
264	P	97.2	Very high	98.4	Very high	54 Å²	54	34.3 Å²	34.3	35%	0.351	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	cis	-86.3	1.2	17.3	35.9	-38.2	0	0	0	116	R292	P264-R292 HydrophobicContact CB-CB 4.17Å; P264-R292 HydrophobicContact CB-CG 4.47Å; P264-R292 WeakPolarHBondContact O-CA 3.46Å
265	G	98.4	Very high	98.4	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	17%	0.168	C	C	.	.	S	Bend	trans	-60.2	159.9	164.9	0	0	0	0	0	111.9	R256 E262 S289 E291	R256-G265 PolarHBondContact NH1-O 2.79Å; E262-G265 WeakPolarHBondContact O-CA 3.33Å; E262-G265 PolarHBondContact O-N 2.76Å; G265-S289 CarbonylContact C-O 3.47Å; G265-S289 WeakPolarHBondContact CA-O 3.47Å; G265-E291 WeakPolarHBondContact CA-O 3.22Å
266	Y	98.6	Very high	98.2	Very high	5 Å²	5	37.3 Å²	37.3	2%	0.02	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	163.5	-171.1	66.6	-84.7	0	0	0	112.1	K217 I268 R287 A288 S289 E291 Y293 D298	K217-Y266 HydrophobicContact CD-CD2 3.81Å; K217-Y266 HydrophobicContact CD-CG 4.09Å; Y266-I268 HydrophobicContact CD2-CD1 4.21Å; Y266-I268 HydrophobicContact CD2-CG1 3.97Å; Y266-I268 HydrophobicContact CE2-CD1 3.95Å; Y266-I268 HydrophobicContact CE2-CG1 4.16Å; Y266-R287 HydrophobicContact CE2-CB 4.41Å; Y266-A288 WeakPolarHBondContact O-CA 3.46Å; Y266-S289 VanDerWaalsContact CE1-CB 3.43Å; Y266-S289 PolarHBondContact N-O 2.96Å; Y266-S289 PolarHBondContact O-N 2.7Å; Y266-E291 WeakPolarHBondContact CD1-O 3.33Å; Y266-E291 WeakPolarHBondContact CE1-O 3.33Å; Y266-Y293 HydrophobicContact CD2-CD2 4.36Å; Y266-Y293 HydrophobicContact CE1-CD2 4.1Å; Y266-Y293 HydrophobicContact CE1-CG 4.45Å; Y266-Y293 AromaticContact CE2-CD2 3.85Å; Y266-Y293 HydrophobicContact CE2-CD2 3.85Å; Y266-Y293 AromaticContact CZ-CD2 3.7Å; Y266-D298 WeakPolarHBondContact CE2-OD1 3.38Å; Y266-D298 VanDerWaalsContact CZ-OD1 3.24Å; Y266-D298 PolarHBondContact OH-OD1 2.87Å
267	M	98.8	Very high	98.2	Very high	1 Å²	1	45.5 Å²	45.5	1%	0.005	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140	131.5	173.5	-178.5	177.1	-76.3	0	0	107.2	R256 I259 I261 H269 P285 R287 A288 L307	R256-M267 HydrophobicContact CB-CB 3.83Å; R256-M267 HydrophobicContact CB-CE 4.07Å; R256-M267 HydrophobicContact CB-SD 4.12Å; I259-M267 HydrophobicContact CD1-CE 3.21Å; I259-M267 HydrophobicContact CG1-CE 3.65Å; I261-M267 HydrophobicContact CD1-CE 4.36Å; M267-H269 PolarHBondContact SD-CE1 2.93Å; M267-P285 HydrophobicContact CE-CG 4.24Å; M267-P285 HydrophobicContact CG-CB 3.51Å; M267-P285 HydrophobicContact CG-CG 4.09Å; M267-P285 HydrophobicContact SD-CB 3.87Å; M267-P285 HydrophobicContact SD-CG 3.86Å; M267-R287 CarbonylContact C-O 3.56Å; M267-R287 WeakPolarHBondContact CA-O 3.26Å; M267-A288 HydrophobicContact CE-CB 4.14Å; M267-A288 HydrophobicContact CG-CB 4.35Å; M267-L307 HydrophobicContact CE-CD1 4.15Å; M267-L307 HydrophobicContact SD-CD1 3.7Å
268	I	98.6	Very high	98.2	Very high	12 Å²	12	42.1 Å²	42.1	6%	0.062	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	125.6	179.8	-64.7	175.4	0	0	0	107.9	I215 K217 Y266 E270 P285 R286 R287 Y293	I215-I268 HydrophobicContact CB-CG2 4.2Å; I215-I268 HydrophobicContact CG2-CG2 4.1Å; K217-I268 HydrophobicContact CD-CD1 4.34Å; K217-I268 HydrophobicContact CD-CG1 3.77Å; K217-I268 HydrophobicContact CG-CG1 4.46Å; Y266-I268 HydrophobicContact CD2-CD1 4.21Å; Y266-I268 HydrophobicContact CD2-CG1 3.97Å; Y266-I268 HydrophobicContact CE2-CD1 3.95Å; Y266-I268 HydrophobicContact CE2-CG1 4.16Å; I268-E270 HydrophobicContact CG2-CG 4.24Å; I268-P285 CarbonylContact O-C 3.5Å; I268-P285 VanDerWaalsContact O-CA 3.26Å; I268-P285 WeakPolarHBondContact O-CA 3.42Å; I268-P285 VanDerWaalsContact O-CB 3.31Å; I268-P285 WeakPolarHBondContact O-CB 3.28Å; I268-R286 HydrophobicContact CG2-CB 4.47Å; I268-R286 PolarHBondContact O-N 3.04Å; I268-R287 HydrophobicContact CB-CB 4.05Å; I268-R287 HydrophobicContact CB-CG 4.41Å; I268-R287 HydrophobicContact CD1-CB 4.1Å; I268-R287 HydrophobicContact CD1-CG 4.13Å; I268-R287 HydrophobicContact CG1-CB 4.27Å; I268-R287 PolarHBondContact N-O 3Å; I268-R287 PolarHBondContact O-N 2.58Å; I268-Y293 HydrophobicContact CD1-CE2 4.47Å
269	H	98.7	Very high	98.1	Very high	1 Å²	1	43.7 Å²	43.7	1%	0.005	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	118.7	179.5	-60.2	-84	0	0	0	110.6	I215 Y252 M267 F283	I215-H269 WeakPolarHBondContact CA-O 3.42Å; I215-H269 PolarHBondContact O-N 3.27Å; Y252-H269 AromaticContact CD1-CD2 3.45Å; Y252-H269 VanDerWaalsContact CD1-CD2 3.45Å; Y252-H269 WeakPolarHBondContact CD1-CD2 3.48Å; Y252-H269 AromaticContact CD1-NE2 3.74Å; Y252-H269 HydrophobicContact CE1-CB 4.19Å; Y252-H269 AromaticContact CE1-CD2 3.68Å; M267-H269 PolarHBondContact SD-CE1 2.93Å; H269-F283 HydrophobicContact CB-CD1 4.34Å; H269-F283 AromaticContact ND1-CD1 3.58Å
270	E	98.6	Very high	98.1	Very high	17 Å²	17	44.3 Å²	44.3	8%	0.079	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	-4.6	172.8	-67.5	173.6	-170.4	0	0	112.1	E201 W202 I268 R286 S331	E201-E270 HydrophobicContact CB-CB 4.46Å; E201-E270 HydrophobicContact CB-CG 4.19Å; E201-E270 HydrophobicContact CG-CG 4.49Å; W202-E270 WeakPolarHBondContact CB-O 3.1Å; I268-E270 HydrophobicContact CG2-CG 4.24Å; E270-R286 HydrophobicContact CG-CB 4.3Å; E270-R286 VanDerWaalsContact OE1-CD 3.26Å; E270-R286 WeakPolarHBondContact OE1-CD 2.9Å; E270-R286 IonicContact OE1-NH1 3.98Å; E270-R286 WeakPolarHBondContact OE2-CD 3.42Å; E270-R286 IonicContact OE2-CZ 3.76Å; E270-R286 IonicContact OE2-NE 3.1Å; E270-R286 IonicContact OE2-NH1 2.86Å; E270-R286 PolarHBondContact OE2-NH1 3.26Å; E270-S331 CarbonylContact C-O 3.56Å; E270-S331 VanDerWaalsContact C-O 3.26Å
271	S	98.7	Very high	98.1	Very high	1 Å²	1	41.9 Å²	41.9	1%	0.007	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	131.8	178.3	76	0	0	0	0	112	L284 F333	S271-L284 PolarHBondContact O-N 3.36Å; S271-L284 WeakPolarHBondContact OG-CB 3.4Å; S271-L284 PolarHBondContact OG-O 2.91Å; S271-F333 WeakPolarHBondContact OG-CD1 3.36Å
272	A	98.8	Very high	98.1	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.5	142.7	176.8	0	0	0	0	0	110.2	W202 F282 F283	W202-A272 HydrophobicContact CB-CB 4.31Å; W202-A272 HydrophobicContact CD2-CB 3.56Å; W202-A272 HydrophobicContact CE3-CB 3.66Å; W202-A272 HydrophobicContact CG-CB 3.87Å; W202-A272 HydrophobicContact CZ2-CB 4.49Å; W202-A272 HydrophobicContact CZ3-CB 4.2Å; A272-F282 CarbonylContact C-O 3.53Å; A272-F282 WeakPolarHBondContact CA-O 3.25Å; A272-F283 HydrophobicContact CB-CD1 3.5Å; A272-F283 HydrophobicContact CB-CE1 3.32Å; A272-F283 HydrophobicContact CB-CE2 4.35Å; A272-F283 HydrophobicContact CB-CG 4.12Å; A272-F283 HydrophobicContact CB-CZ 3.79Å
273	Q	98.7	Very high	98.2	Very high	3 Å²	3	33.8 Å²	33.8	1%	0.014	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	150.4	171.5	-65.4	-60.8	-29.6	0	0	110.5	M203 F282 F333 F335	M203-Q273 PolarHBondContact O-NE2 2.76Å; Q273-F282 PolarHBondContact N-O 2.82Å; Q273-F282 PolarHBondContact O-N 2.67Å; Q273-F333 HydrophobicContact CB-CD2 4.46Å; Q273-F333 HydrophobicContact CB-CE1 4.35Å; Q273-F333 HydrophobicContact CB-CE2 3.52Å; Q273-F333 HydrophobicContact CB-CZ 3.44Å; Q273-F333 VanDerWaalsContact CB-CZ 3.44Å; Q273-F333 HydrophobicContact CG-CD1 4.46Å; Q273-F333 HydrophobicContact CG-CD2 3.91Å; Q273-F333 HydrophobicContact CG-CE1 4.04Å; Q273-F333 HydrophobicContact CG-CE2 3.42Å; Q273-F333 VanDerWaalsContact CG-CE2 3.42Å; Q273-F333 HydrophobicContact CG-CG 4.41Å; Q273-F333 HydrophobicContact CG-CZ 3.49Å; Q273-F333 VanDerWaalsContact CG-CZ 3.49Å; Q273-F333 WeakPolarHBondContact CG-O 3.45Å; Q273-F333 PolarHBondContact NE2-O 3.1Å; Q273-F335 HydrophobicContact CB-CD2 4.28Å; Q273-F335 HydrophobicContact CB-CE2 3.66Å; Q273-F335 HydrophobicContact CB-CZ 4.32Å
274	W	98.5	Very high	98.2	Very high	24 Å²	24	29 Å²	29	9%	0.091	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	126.1	167.7	174	-101.4	0	0	0	109.4	K206 M276 S279 W281 A311	K206-W274 HydrophobicContact CB-CB 3.94Å; K206-W274 HydrophobicContact CB-CD2 4.45Å; K206-W274 HydrophobicContact CB-CG 3.79Å; K206-W274 HydrophobicContact CD-CB 4.41Å; K206-W274 HydrophobicContact CD-CD2 3.55Å; K206-W274 HydrophobicContact CD-CE3 3.83Å; K206-W274 HydrophobicContact CD-CG 3.81Å; K206-W274 HydrophobicContact CD-CZ2 4.37Å; K206-W274 HydrophobicContact CD-CZ3 4.35Å; K206-W274 HydrophobicContact CG-CB 4.4Å; K206-W274 HydrophobicContact CG-CD2 3.93Å; K206-W274 HydrophobicContact CG-CG 3.75Å; W274-M276 PolarHBondContact NE1-SD 3.31Å; W274-S279 WeakPolarHBondContact CH2-O 3.35Å; W274-W281 HydrophobicContact CB-CD2 4.41Å; W274-W281 HydrophobicContact CB-CE3 3.93Å; W274-W281 HydrophobicContact CB-CH2 4.08Å; W274-W281 HydrophobicContact CB-CZ3 3.77Å; W274-W281 HydrophobicContact CE3-CB 4.39Å; W274-W281 AromaticContact CE3-CD1 3.71Å; W274-W281 AromaticContact CE3-CD2 3.66Å; W274-W281 HydrophobicContact CE3-CD2 3.66Å; W274-W281 AromaticContact CE3-CE2 3.66Å; W274-W281 HydrophobicContact CE3-CE3 4.32Å; W274-W281 AromaticContact CE3-CG 3.68Å; W274-W281 HydrophobicContact CE3-CG 3.68Å; W274-W281 HydrophobicContact CE3-CZ2 4.31Å; W274-W281 AromaticContact CE3-NE1 3.7Å; W274-W281 AromaticContact CZ3-CD1 3.67Å; W274-W281 HydrophobicContact CZ3-CD2 4.4Å; W274-W281 HydrophobicContact CZ3-CG 4.03Å; W274-W281 AromaticContact CZ3-NE1 3.81Å; W274-A311 HydrophobicContact CH2-CB 3.81Å; W274-A311 HydrophobicContact CZ3-CB 4.13Å
275	S	98.4	Very high	98.3	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	116.5	170.5	172.9	0	0	0	0	110	R277 H278 S279 Q280 D341	S275-R277 VanDerWaalsContact C-N 3.26Å; S275-R277 PolarHBondContact O-N 3.31Å; S275-R277 PolarHBondContact OG-N 2.91Å; S275-H278 PolarHBondContact OG-CD2 3.07Å; S275-H278 PolarHBondContact OG-N 3.21Å; S275-S279 VanDerWaalsContact O-CA 3.27Å; S275-S279 WeakPolarHBondContact O-CA 3.45Å; S275-S279 PolarHBondContact O-N 3.17Å; S275-Q280 PolarHBondContact N-O 2.86Å; S275-Q280 PolarHBondContact O-N 3.06Å; S275-D341 WeakPolarHBondContact CB-OD2 3.35Å; S275-D341 PolarHBondContact OG-OD2 3.07Å
276	M	95.7	Very high	98.3	Very high	123 Å²	123	26.8 Å²	26.8	61%	0.606	13%	0.126	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.7	-30.4	169	-70	-64.2	-65.4	0	0	111.7	W274	W274-M276 PolarHBondContact NE1-SD 3.31Å
277	R	97.5	Very high	98.3	Very high	184 Å²	184	26.8 Å²	26.8	69%	0.694	13%	0.126	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.4	-40.9	-179.7	-62.1	-61.8	-179	-176	-2.1	112.3	S275 D341	S275-R277 VanDerWaalsContact C-N 3.26Å; S275-R277 PolarHBondContact O-N 3.31Å; S275-R277 PolarHBondContact OG-N 2.91Å; R277-D341 HydrophobicContact CB-CB 4.24Å; R277-D341 WeakPolarHBondContact CB-OD2 3.21Å; R277-D341 HydrophobicContact CG-CB 4.38Å; R277-D341 WeakPolarHBondContact CG-OD2 3.43Å
278	H	97.5	Very high	98.3	Very high	62 Å²	62	27.7 Å²	27.7	29%	0.287	13%	0.133	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.3	-12.4	179.3	-59.2	-64.9	0	0	0	113.2	S275 Q280 F282 G340 D341	S275-H278 PolarHBondContact OG-CD2 3.07Å; S275-H278 PolarHBondContact OG-N 3.21Å; H278-Q280 VanDerWaalsContact C-N 3.26Å; H278-Q280 HydrophobicContact CB-CB 4.25Å; H278-Q280 WeakPolarHBondContact O-CG 3.31Å; H278-Q280 PolarHBondContact O-N 2.93Å; H278-F282 HydrophobicContact CB-CE2 4.04Å; H278-F282 HydrophobicContact CB-CZ 4.21Å; H278-F282 AromaticContact CD2-CZ 3.63Å; H278-G340 PolarHBondContact NE2-O 3.22Å; H278-D341 PolarHBondContact NE2-O 3.25Å
279	S	96.8	Very high	98.3	Very high	74 Å²	74	27.5 Å²	27.5	52%	0.517	13%	0.133	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.9	43.1	-171.8	-61.8	0	0	0	0	112.6	W274 S275	W274-S279 WeakPolarHBondContact CH2-O 3.35Å; S275-S279 VanDerWaalsContact O-CA 3.27Å; S275-S279 WeakPolarHBondContact O-CA 3.45Å; S275-S279 PolarHBondContact O-N 3.17Å
280	Q	98	Very high	98.3	Very high	49 Å²	49	34.8 Å²	34.8	23%	0.229	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	148.7	-173	-75.3	-178.1	-46.5	0	0	111.6	S275 H278 F282 A309	S275-Q280 PolarHBondContact N-O 2.86Å; S275-Q280 PolarHBondContact O-N 3.06Å; H278-Q280 VanDerWaalsContact C-N 3.26Å; H278-Q280 HydrophobicContact CB-CB 4.25Å; H278-Q280 WeakPolarHBondContact O-CG 3.31Å; H278-Q280 PolarHBondContact O-N 2.93Å; Q280-F282 HydrophobicContact CB-CD2 4.28Å; Q280-F282 HydrophobicContact CB-CE2 3.82Å; Q280-A309 CarbonylContact C-O 3.52Å; Q280-A309 WeakPolarHBondContact CA-O 3.43Å; Q280-A309 VanDerWaalsContact CB-O 3.25Å; Q280-A309 WeakPolarHBondContact CB-O 3.45Å; Q280-A309 WeakPolarHBondContact CG-O 3.5Å
281	W	98.6	Very high	98.2	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	138.6	164.2	-72.7	108	0	0	0	110	A204 K206 Y211 W248 W274 F283 R308 A309 F313	A204-W281 HydrophobicContact CB-CH2 4.32Å; A204-W281 HydrophobicContact CB-CZ3 3.69Å; K206-W281 HydrophobicContact CB-CH2 4.21Å; K206-W281 HydrophobicContact CB-CZ2 4.39Å; K206-W281 HydrophobicContact CD-CH2 4.05Å; K206-W281 HydrophobicContact CD-CZ2 3.4Å; Y211-W281 HydrophobicContact CD1-CH2 4.08Å; Y211-W281 HydrophobicContact CD1-CZ2 4.28Å; Y211-W281 HydrophobicContact CD2-CH2 4.31Å; Y211-W281 HydrophobicContact CE1-CZ2 4.38Å; Y211-W281 AromaticContact CG-CH2 3.95Å; Y211-W281 HydrophobicContact CG-CH2 3.95Å; W248-W281 HydrophobicContact CH2-CD2 4.42Å; W248-W281 AromaticContact CH2-CE2 3.82Å; W248-W281 AromaticContact CH2-CH2 3.85Å; W248-W281 HydrophobicContact CH2-CH2 3.85Å; W248-W281 AromaticContact CH2-CZ2 3.52Å; W248-W281 HydrophobicContact CH2-CZ2 3.52Å; W248-W281 HydrophobicContact CH2-CZ3 4.41Å; W248-W281 HydrophobicContact CZ2-CZ2 4.18Å; W274-W281 HydrophobicContact CB-CD2 4.41Å; W274-W281 HydrophobicContact CB-CE3 3.93Å; W274-W281 HydrophobicContact CB-CH2 4.08Å; W274-W281 HydrophobicContact CB-CZ3 3.77Å; W274-W281 HydrophobicContact CE3-CB 4.39Å; W274-W281 AromaticContact CE3-CD1 3.71Å; W274-W281 AromaticContact CE3-CD2 3.66Å; W274-W281 HydrophobicContact CE3-CD2 3.66Å; W274-W281 AromaticContact CE3-CE2 3.66Å; W274-W281 HydrophobicContact CE3-CE3 4.32Å; W274-W281 AromaticContact CE3-CG 3.68Å; W274-W281 HydrophobicContact CE3-CG 3.68Å; W274-W281 HydrophobicContact CE3-CZ2 4.31Å; W274-W281 AromaticContact CE3-NE1 3.7Å; W274-W281 AromaticContact CZ3-CD1 3.67Å; W274-W281 HydrophobicContact CZ3-CD2 4.4Å; W274-W281 HydrophobicContact CZ3-CG 4.03Å; W274-W281 AromaticContact CZ3-NE1 3.81Å; W281-F283 HydrophobicContact CB-CD2 4.31Å; W281-F283 HydrophobicContact CB-CE2 3.84Å; W281-F283 HydrophobicContact CG-CE2 4.38Å; W281-R308 CarbonylContact O-C 3.59Å; W281-R308 VanDerWaalsContact O-CA 3.26Å; W281-R308 WeakPolarHBondContact O-CA 3.38Å; W281-A309 HydrophobicContact CB-CB 4.37Å; W281-A309 PolarHBondContact N-O 2.67Å; W281-A309 PolarHBondContact O-N 3.49Å; W281-F313 HydrophobicContact CB-CE1 4.36Å; W281-F313 HydrophobicContact CB-CZ 4.3Å; W281-F313 AromaticContact CD1-CE2 3.69Å; W281-F313 AromaticContact CD1-CZ 3.54Å; W281-F313 HydrophobicContact CD2-CZ 4.44Å; W281-F313 HydrophobicContact CG-CE1 4.39Å; W281-F313 HydrophobicContact CG-CE2 4.44Å; W281-F313 AromaticContact CG-CZ 3.85Å; W281-F313 HydrophobicContact CG-CZ 3.85Å; W281-F313 AromaticContact NE1-CE2 3.88Å; W281-F313 AromaticContact NE1-CZ 3.97Å
282	F	98.9	Very high	98.2	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	131.1	175.5	-75.6	-121.4	0	0	0	107.8	A272 Q273 H278 Q280 L306 L307 R308 F333 F335 I344 I365	A272-F282 CarbonylContact C-O 3.53Å; A272-F282 WeakPolarHBondContact CA-O 3.25Å; Q273-F282 PolarHBondContact N-O 2.82Å; Q273-F282 PolarHBondContact O-N 2.67Å; H278-F282 HydrophobicContact CB-CE2 4.04Å; H278-F282 HydrophobicContact CB-CZ 4.21Å; H278-F282 AromaticContact CD2-CZ 3.63Å; Q280-F282 HydrophobicContact CB-CD2 4.28Å; Q280-F282 HydrophobicContact CB-CE2 3.82Å; F282-L306 HydrophobicContact CB-CD1 4.28Å; F282-L306 HydrophobicContact CD1-CD1 3.79Å; F282-L306 HydrophobicContact CD1-CD2 4.26Å; F282-L306 HydrophobicContact CD1-CG 4.46Å; F282-L306 HydrophobicContact CE1-CD2 4.42Å; F282-L306 HydrophobicContact CG-CD1 4.46Å; F282-L307 CarbonylContact C-O 3.56Å; F282-L307 VanDerWaalsContact CA-O 3.31Å; F282-L307 WeakPolarHBondContact CA-O 3.39Å; F282-R308 HydrophobicContact CD1-CG 3.73Å; F282-R308 HydrophobicContact CD2-CG 4.35Å; F282-R308 HydrophobicContact CE1-CG 3.57Å; F282-R308 HydrophobicContact CE2-CG 4.22Å; F282-R308 HydrophobicContact CG-CG 4.09Å; F282-R308 VanDerWaalsContact CZ-CD 3.48Å; F282-R308 HydrophobicContact CZ-CG 3.82Å; F282-F333 HydrophobicContact CB-CE2 4.15Å; F282-F333 HydrophobicContact CB-CZ 3.66Å; F282-F333 WeakPolarHBondContact O-CZ 3.39Å; F282-F335 HydrophobicContact CB-CZ 4.03Å; F282-F335 AromaticContact CD1-CE1 3.86Å; F282-F335 HydrophobicContact CD1-CE1 3.86Å; F282-F335 AromaticContact CD1-CZ 3.83Å; F282-F335 HydrophobicContact CD1-CZ 3.83Å; F282-F335 HydrophobicContact CD2-CE1 4.49Å; F282-F335 AromaticContact CD2-CZ 3.75Å; F282-F335 HydrophobicContact CD2-CZ 3.75Å; F282-F335 HydrophobicContact CE1-CE1 4.02Å; F282-F335 HydrophobicContact CE1-CZ 4.22Å; F282-F335 HydrophobicContact CE2-CZ 4.14Å; F282-F335 HydrophobicContact CG-CE1 4.14Å; F282-F335 AromaticContact CG-CZ 3.62Å; F282-F335 HydrophobicContact CG-CZ 3.62Å; F282-F335 HydrophobicContact CZ-CE1 4.42Å; F282-F335 HydrophobicContact CZ-CZ 4.38Å; F282-I344 HydrophobicContact CD1-CD1 4.31Å; F282-I365 HydrophobicContact CD1-CG2 4.5Å; F282-I365 HydrophobicContact CE1-CB 4.29Å; F282-I365 HydrophobicContact CE1-CG2 3.71Å
283	F	98.9	Very high	98.1	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	136.6	174.6	-72.8	-99.8	0	0	0	109.7	W202 W248 Y252 L255 H269 A272 W281 L307 F313	W202-F283 HydrophobicContact CZ2-CE1 4.18Å; W202-F283 HydrophobicContact CZ2-CZ 4.4Å; W248-F283 HydrophobicContact CZ3-CZ 4.22Å; Y252-F283 HydrophobicContact CE1-CE1 4.29Å; L255-F283 HydrophobicContact CD1-CD1 4.04Å; L255-F283 HydrophobicContact CD1-CD2 3.76Å; L255-F283 HydrophobicContact CD1-CE1 4.04Å; L255-F283 HydrophobicContact CD1-CE2 3.78Å; L255-F283 HydrophobicContact CD1-CG 3.9Å; L255-F283 HydrophobicContact CD1-CZ 3.92Å; L255-F283 HydrophobicContact CD2-CD2 4.02Å; L255-F283 HydrophobicContact CD2-CE2 4.45Å; H269-F283 HydrophobicContact CB-CD1 4.34Å; H269-F283 AromaticContact ND1-CD1 3.58Å; A272-F283 HydrophobicContact CB-CD1 3.5Å; A272-F283 HydrophobicContact CB-CE1 3.32Å; A272-F283 HydrophobicContact CB-CE2 4.35Å; A272-F283 HydrophobicContact CB-CG 4.12Å; A272-F283 HydrophobicContact CB-CZ 3.79Å; W281-F283 HydrophobicContact CB-CD2 4.31Å; W281-F283 HydrophobicContact CB-CE2 3.84Å; W281-F283 HydrophobicContact CG-CE2 4.38Å; F283-L307 HydrophobicContact CB-CB 4.25Å; F283-L307 PolarHBondContact N-O 3.41Å; F283-L307 PolarHBondContact O-N 3.15Å; F283-F313 AromaticContact CE2-CE1 3.71Å; F283-F313 HydrophobicContact CE2-CE1 3.71Å; F283-F313 HydrophobicContact CE2-CZ 4.07Å; F283-F313 HydrophobicContact CZ-CE1 4.28Å; F283-F313 HydrophobicContact CZ-CZ 4.39Å
284	L	98.9	Very high	98.1	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	95.2	165.4	-60.6	161.9	0	0	0	107.1	S271 L306 F330 F333 I344 A346 F363	S271-L284 PolarHBondContact O-N 3.36Å; S271-L284 WeakPolarHBondContact OG-CB 3.4Å; S271-L284 PolarHBondContact OG-O 2.91Å; L284-L306 HydrophobicContact CD2-CB 3.74Å; L284-L306 HydrophobicContact CD2-CD1 3.72Å; L284-L306 HydrophobicContact CD2-CG 4.31Å; L284-L306 HydrophobicContact CG-CD1 4.12Å; L284-F330 HydrophobicContact CB-CB 3.59Å; L284-F330 HydrophobicContact CB-CD1 4.27Å; L284-F330 HydrophobicContact CB-CD2 3.73Å; L284-F330 HydrophobicContact CB-CE2 4.39Å; L284-F330 HydrophobicContact CB-CG 3.63Å; L284-F330 HydrophobicContact CD1-CD1 4Å; L284-F330 HydrophobicContact CD1-CE1 4.27Å; L284-F330 HydrophobicContact CD1-CG 4.21Å; L284-F330 HydrophobicContact CD2-CD2 4.14Å; L284-F330 HydrophobicContact CD2-CE1 4.49Å; L284-F330 HydrophobicContact CD2-CE2 3.95Å; L284-F330 HydrophobicContact CD2-CG 4.46Å; L284-F330 HydrophobicContact CD2-CZ 4.15Å; L284-F330 HydrophobicContact CG-CD2 4.41Å; L284-F330 HydrophobicContact CG-CG 4.34Å; L284-F333 HydrophobicContact CB-CD1 4.39Å; L284-F333 HydrophobicContact CD1-CB 3.71Å; L284-F333 HydrophobicContact CD1-CD1 3.48Å; L284-F333 VanDerWaalsContact CD1-CD1 3.48Å; L284-F333 HydrophobicContact CD1-CD2 4.35Å; L284-F333 HydrophobicContact CD1-CE1 4.15Å; L284-F333 HydrophobicContact CD1-CG 3.59Å; L284-F333 HydrophobicContact CG-CD1 4.03Å; L284-F333 HydrophobicContact CG-CE1 4.25Å; L284-I344 HydrophobicContact CD1-CG2 4.37Å; L284-A346 HydrophobicContact CD1-CB 4.12Å; L284-F363 HydrophobicContact CD1-CE1 4.48Å; L284-F363 HydrophobicContact CD1-CZ 3.7Å; L284-F363 HydrophobicContact CD2-CE2 4.29Å; L284-F363 HydrophobicContact CD2-CZ 3.86Å; L284-F363 HydrophobicContact CG-CZ 4.46Å
285	P	98.8	Very high	97.8	Very high	0 Å²	0	54.6 Å²	54.6	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.9	137.4	179.7	24.1	-30.8	0	0	0	111.1	M267 I268 T303 V305 L307	M267-P285 HydrophobicContact CE-CG 4.24Å; M267-P285 HydrophobicContact CG-CB 3.51Å; M267-P285 HydrophobicContact CG-CG 4.09Å; M267-P285 HydrophobicContact SD-CB 3.87Å; M267-P285 HydrophobicContact SD-CG 3.86Å; I268-P285 CarbonylContact O-C 3.5Å; I268-P285 VanDerWaalsContact O-CA 3.26Å; I268-P285 WeakPolarHBondContact O-CA 3.42Å; I268-P285 VanDerWaalsContact O-CB 3.31Å; I268-P285 WeakPolarHBondContact O-CB 3.28Å; P285-T303 HydrophobicContact CB-CG2 4.38Å; P285-T303 HydrophobicContact CG-CG2 4.21Å; P285-T303 PolarHBondContact O-OG1 3.27Å; P285-V305 WeakPolarHBondContact CD-O 3.33Å; P285-L307 HydrophobicContact CG-CD1 4.38Å
286	R	98.6	Very high	97.6	Very high	6 Å²	6	59.3 Å²	59.3	2%	0.023	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.3	-51.9	174.5	-168.8	-155.3	-171.2	102.1	-6.5	110.1	I268 E270 A302 T303 G329 F330 S349 E351 E383	I268-R286 HydrophobicContact CG2-CB 4.47Å; I268-R286 PolarHBondContact O-N 3.04Å; E270-R286 HydrophobicContact CG-CB 4.3Å; E270-R286 VanDerWaalsContact OE1-CD 3.26Å; E270-R286 WeakPolarHBondContact OE1-CD 2.9Å; E270-R286 IonicContact OE1-NH1 3.98Å; E270-R286 WeakPolarHBondContact OE2-CD 3.42Å; E270-R286 IonicContact OE2-CZ 3.76Å; E270-R286 IonicContact OE2-NE 3.1Å; E270-R286 IonicContact OE2-NH1 2.86Å; E270-R286 PolarHBondContact OE2-NH1 3.26Å; R286-A302 VanDerWaalsContact O-CA 3.28Å; R286-A302 WeakPolarHBondContact O-CA 3.44Å; R286-T303 PolarHBondContact O-N 2.54Å; R286-T303 VanDerWaalsContact O-N 3.15Å; R286-G329 VanDerWaalsContact O-CA 3.31Å; R286-G329 WeakPolarHBondContact O-CA 3.15Å; R286-F330 VanDerWaalsContact CA-O 3.24Å; R286-F330 WeakPolarHBondContact CA-O 3.37Å; R286-F330 VanDerWaalsContact CB-O 3.23Å; R286-F330 WeakPolarHBondContact CB-O 3.42Å; R286-F330 PolarHBondContact N-O 2.71Å; R286-S349 PolarHBondContact NH1-OG 3.22Å; R286-S349 PolarHBondContact NH2-OG 3.21Å; R286-E351 IonicContact CZ-OE1 2.88Å; R286-E351 IonicContact NH1-OE1 3.45Å; R286-E351 IonicContact NH2-OE1 2.87Å; R286-E351 PolarHBondContact NH2-OE1 3.02Å; R286-E383 IonicContact CZ-OE1 3.39Å; R286-E383 IonicContact NH1-OE1 2.84Å; R286-E383 PolarHBondContact NH1-OE1 3.17Å
287	R	98.5	Very high	97.7	Very high	5 Å²	5	57.7 Å²	57.7	2%	0.019	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	150.4	-174.7	-49.3	-64.9	-173.9	173.3	0.7	112.2	Y266 M267 I268 D298 E299 R301 T327	Y266-R287 HydrophobicContact CE2-CB 4.41Å; M267-R287 CarbonylContact C-O 3.56Å; M267-R287 WeakPolarHBondContact CA-O 3.26Å; I268-R287 HydrophobicContact CB-CB 4.05Å; I268-R287 HydrophobicContact CB-CG 4.41Å; I268-R287 HydrophobicContact CD1-CB 4.1Å; I268-R287 HydrophobicContact CD1-CG 4.13Å; I268-R287 HydrophobicContact CG1-CB 4.27Å; I268-R287 PolarHBondContact N-O 3Å; I268-R287 PolarHBondContact O-N 2.58Å; R287-D298 WeakPolarHBondContact CD-O 3.17Å; R287-D298 PolarHBondContact NE-O 3.1Å; R287-D298 PolarHBondContact NH1-O 2.66Å; R287-E299 PolarHBondContact NH1-O 3.22Å; R287-E299 PolarHBondContact NH2-O 3.32Å; R287-R301 CarbonylContact C-O 3.56Å; R287-R301 WeakPolarHBondContact CA-O 3.49Å; R287-R301 HydrophobicContact CB-CB 4.35Å; R287-R301 WeakPolarHBondContact CB-O 3.35Å; R287-T327 PolarHBondContact NH1-O 3.48Å
288	A	98.5	Very high	97.7	Very high	20 Å²	20	49.9 Å²	49.9	17%	0.165	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153	135.8	169.2	0	0	0	0	0	111.4	I259 I261 Y266 M267 R301 T303	I259-A288 HydrophobicContact CD1-CB 4.29Å; I261-A288 HydrophobicContact CD1-CB 3.73Å; Y266-A288 WeakPolarHBondContact O-CA 3.46Å; M267-A288 HydrophobicContact CE-CB 4.14Å; M267-A288 HydrophobicContact CG-CB 4.35Å; A288-R301 PolarHBondContact N-O 2.79Å; A288-T303 HydrophobicContact CB-CG2 3.39Å; A288-T303 VanDerWaalsContact N-CG2 3.27Å
289	S	98.4	Very high	97.7	Very high	8 Å²	8	49.4 Å²	49.4	6%	0.056	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	142.2	-179.8	-173.4	0	0	0	0	111.1	I261 G265 Y266 E291 R301	I261-S289 WeakPolarHBondContact CG2-O 3.48Å; G265-S289 CarbonylContact C-O 3.47Å; G265-S289 WeakPolarHBondContact CA-O 3.47Å; Y266-S289 VanDerWaalsContact CE1-CB 3.43Å; Y266-S289 PolarHBondContact N-O 2.96Å; Y266-S289 PolarHBondContact O-N 2.7Å; S289-E291 VanDerWaalsContact C-N 3.25Å; S289-E291 WeakPolarHBondContact OG-CB 3.16Å; S289-E291 PolarHBondContact OG-N 2.81Å; S289-E291 PolarHBondContact OG-O 2.91Å; S289-R301 PolarHBondContact OG-NE 2.92Å
290	K	98.3	Very high	97.7	Very high	154 Å²	154	49.5 Å²	49.5	67%	0.67	24%	0.237	S	C	*	.	S	Bend	trans	-81.3	-10.4	166.6	-67.4	-175.9	177.1	-174.1	0	112.4	I261	I261-K290 HydrophobicContact CG1-CG 4.02Å
291	E	98.1	Very high	97.7	Very high	115 Å²	115	49.3 Å²	49.3	54%	0.537	23%	0.234	S	C	.	.	S	Bend	trans	-99.7	162.3	-178.3	-58.5	174.3	164.7	0	0	110.8	G265 Y266 S289 R301	G265-E291 WeakPolarHBondContact CA-O 3.22Å; Y266-E291 WeakPolarHBondContact CD1-O 3.33Å; Y266-E291 WeakPolarHBondContact CE1-O 3.33Å; S289-E291 VanDerWaalsContact C-N 3.25Å; S289-E291 WeakPolarHBondContact OG-CB 3.16Å; S289-E291 PolarHBondContact OG-N 2.81Å; S289-E291 PolarHBondContact OG-O 2.91Å; E291-R301 IonicContact OE2-CZ 3.25Å; E291-R301 IonicContact OE2-NE 3.22Å; E291-R301 IonicContact OE2-NH2 2.58Å; E291-R301 PolarHBondContact OE2-NH2 2.85Å
292	R	97.5	Very high	97.7	Very high	152 Å²	152	49.7 Å²	49.7	57%	0.574	24%	0.237	S	C	*	.	P	Polyproline II helix	trans	-59	142.1	175.3	-177.7	-178.3	-68.1	148	1.7	110.9	P264	P264-R292 HydrophobicContact CB-CB 4.17Å; P264-R292 HydrophobicContact CB-CG 4.47Å; P264-R292 WeakPolarHBondContact O-CA 3.46Å
293	Y	97.8	Very high	97.7	Very high	41 Å²	41	50 Å²	50	16%	0.161	24%	0.239	C	C	.	.	P	Polyproline II helix	trans	-54.7	136	172	-179.5	-96	0	0	0	113.1	T220 D223 G224 Y266 I268 D298	T220-Y293 WeakPolarHBondContact OG1-CD1 3.43Å; D223-Y293 CarbonylContact C-O 3.54Å; G224-Y293 VanDerWaalsContact CA-O 3.3Å; G224-Y293 WeakPolarHBondContact CA-O 3.32Å; G224-Y293 PolarHBondContact N-O 3.21Å; Y266-Y293 HydrophobicContact CD2-CD2 4.36Å; Y266-Y293 HydrophobicContact CE1-CD2 4.1Å; Y266-Y293 HydrophobicContact CE1-CG 4.45Å; Y266-Y293 AromaticContact CE2-CD2 3.85Å; Y266-Y293 HydrophobicContact CE2-CD2 3.85Å; Y266-Y293 AromaticContact CZ-CD2 3.7Å; I268-Y293 HydrophobicContact CD1-CE2 4.47Å; Y293-D298 HydrophobicContact CD2-CB 4.39Å; Y293-D298 HydrophobicContact CE2-CB 3.87Å
294	S	97	Very high	97.7	Very high	39 Å²	39	50.8 Å²	50.8	27%	0.273	24%	0.243	S	C	.	.			trans	-148.2	131.7	167.5	163.6	0	0	0	0	106.8	T296 E297 D298	S294-T296 VanDerWaalsContact C-N 3.26Å; S294-T296 PolarHBondContact O-N 2.77Å; S294-E297 PolarHBondContact O-N 3.09Å; S294-E297 VanDerWaalsContact O-N 3.15Å; S294-D298 WeakPolarHBondContact O-CB 3.24Å; S294-D298 PolarHBondContact O-N 3.35Å
295	E	93.8	Very high	97.6	Very high	115 Å²	115	51.1 Å²	51.1	54%	0.537	25%	0.245	S	C	.	.	H	α-helix	trans	-53.8	-42.8	-178.5	-171.7	167.5	-144.4	0	0	112.3	V222	V222-E295 PolarHBondContact O-N 3.35Å
296	T	94.2	Very high	97.7	Very high	99 Å²	99	51.1 Å²	51.1	61%	0.607	25%	0.245	S	C	*	.	H	α-helix	trans	-67.7	-40.7	178.9	-52	0	0	0	0	113.2	S294	S294-T296 VanDerWaalsContact C-N 3.26Å; S294-T296 PolarHBondContact O-N 2.77Å
297	E	96.8	Very high	97.7	Very high	89 Å²	89	50.8 Å²	50.8	42%	0.416	24%	0.244	S	C	.	.	H	α-helix	trans	-76.2	-30.6	-177.7	-71.7	-62.4	135.8	0	0	111.7	S294 E299 H300 R301	S294-E297 PolarHBondContact O-N 3.09Å; S294-E297 VanDerWaalsContact O-N 3.15Å; E297-E299 VanDerWaalsContact C-N 3.26Å; E297-E299 PolarHBondContact O-N 3.01Å; E297-H300 PolarHBondContact O-N 2.73Å; E297-R301 WeakPolarHBondContact O-CG 3.38Å; E297-R301 PolarHBondContact O-NH1 2.86Å; E297-R301 VanDerWaalsContact O-NH1 3.15Å; E297-R301 IonicContact OE2-CZ 3.8Å; E297-R301 IonicContact OE2-NH1 2.8Å; E297-R301 PolarHBondContact OE2-NH1 2.91Å; E297-R301 IonicContact OE2-NH2 2.89Å; E297-R301 PolarHBondContact OE2-NH2 2.94Å
298	D	97.5	Very high	97.7	Very high	20 Å²	20	53.3 Å²	53.3	11%	0.107	25%	0.253	C	S	.	.	H	α-helix	trans	-61.5	-32.2	-176.3	-168	56	0	0	0	113.2	Y266 R287 Y293 S294 H300 R301	Y266-D298 WeakPolarHBondContact CE2-OD1 3.38Å; Y266-D298 VanDerWaalsContact CZ-OD1 3.24Å; Y266-D298 PolarHBondContact OH-OD1 2.87Å; R287-D298 WeakPolarHBondContact CD-O 3.17Å; R287-D298 PolarHBondContact NE-O 3.1Å; R287-D298 PolarHBondContact NH1-O 2.66Å; Y293-D298 HydrophobicContact CD2-CB 4.39Å; Y293-D298 HydrophobicContact CE2-CB 3.87Å; S294-D298 WeakPolarHBondContact O-CB 3.24Å; S294-D298 PolarHBondContact O-N 3.35Å; D298-H300 PolarHBondContact O-N 2.81Å; D298-R301 PolarHBondContact O-N 2.77Å
299	E	97.1	Very high	97.7	Very high	51 Å²	51	52.4 Å²	52.4	24%	0.238	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.6	-26.2	172.2	-65.5	-170.6	170	0	0	112.4	R287 E297 T327 E351 I352 G353	R287-E299 PolarHBondContact NH1-O 3.22Å; R287-E299 PolarHBondContact NH2-O 3.32Å; E297-E299 VanDerWaalsContact C-N 3.26Å; E297-E299 PolarHBondContact O-N 3.01Å; E299-T327 WeakPolarHBondContact O-CA 3.29Å; E299-E351 WeakPolarHBondContact CG-O 3.08Å; E299-I352 HydrophobicContact CB-CD1 3.92Å; E299-G353 PolarHBondContact OE1-N 2.85Å; E299-G353 PolarHBondContact OE2-N 2.94Å; E299-G353 VanDerWaalsContact OE2-N 3.11Å
300	H	98.1	Very high	97.6	Very high	77 Å²	77	53.3 Å²	53.3	36%	0.356	25%	0.25	S	C	.	.	T	Hydrogen-bonded Turn	trans	-109.5	17	-179.1	-59.4	82.9	0	0	0	113.8	E297 D298 L326	E297-H300 PolarHBondContact O-N 2.73Å; D298-H300 PolarHBondContact O-N 2.81Å; H300-L326 CarbonylContact C-O 3.46Å; H300-L326 WeakPolarHBondContact CA-O 3.37Å
301	R	98.2	Very high	97.4	Very high	45 Å²	45	47.2 Å²	47.2	17%	0.17	23%	0.228	C	C	.	.			trans	-107.6	25.3	179.4	-62.2	-57.7	-175.5	-84.6	3.6	113.4	R287 A288 S289 E291 E297 D298 L326	R287-R301 CarbonylContact C-O 3.56Å; R287-R301 WeakPolarHBondContact CA-O 3.49Å; R287-R301 HydrophobicContact CB-CB 4.35Å; R287-R301 WeakPolarHBondContact CB-O 3.35Å; A288-R301 PolarHBondContact N-O 2.79Å; S289-R301 PolarHBondContact OG-NE 2.92Å; E291-R301 IonicContact OE2-CZ 3.25Å; E291-R301 IonicContact OE2-NE 3.22Å; E291-R301 IonicContact OE2-NH2 2.58Å; E291-R301 PolarHBondContact OE2-NH2 2.85Å; E297-R301 WeakPolarHBondContact O-CG 3.38Å; E297-R301 PolarHBondContact O-NH1 2.86Å; E297-R301 VanDerWaalsContact O-NH1 3.15Å; E297-R301 IonicContact OE2-CZ 3.8Å; E297-R301 IonicContact OE2-NH1 2.8Å; E297-R301 PolarHBondContact OE2-NH1 2.91Å; E297-R301 IonicContact OE2-NH2 2.89Å; E297-R301 PolarHBondContact OE2-NH2 2.94Å; D298-R301 PolarHBondContact O-N 2.77Å; R301-L326 PolarHBondContact N-O 2.81Å
302	A	98.5	Very high	97.2	Very high	7 Å²	7	42.8 Å²	42.8	6%	0.058	21%	0.209	C	C	.	.	B	Isolated β-bridge	trans	-58.9	158.3	178.1	0	0	0	0	0	113	R286 L324 S325 L326 R328	R286-A302 VanDerWaalsContact O-CA 3.28Å; R286-A302 WeakPolarHBondContact O-CA 3.44Å; A302-L324 WeakPolarHBondContact O-CD1 3.3Å; A302-S325 WeakPolarHBondContact CB-O 3.16Å; A302-L326 VanDerWaalsContact CB-C 3.48Å; A302-L326 VanDerWaalsContact CB-O 3.23Å; A302-L326 WeakPolarHBondContact CB-O 3.47Å; A302-L326 PolarHBondContact N-O 3.38Å; A302-R328 VanDerWaalsContact CB-C 3.43Å; A302-R328 WeakPolarHBondContact CB-O 3.46Å
303	T	98.1	Very high	97.1	Very high	8 Å²	8	35.6 Å²	35.6	5%	0.049	18%	0.182	C	C	.	.			trans	-120.9	160.5	178.2	95.4	0	0	0	0	112.6	P285 R286 A288 V305	P285-T303 HydrophobicContact CB-CG2 4.38Å; P285-T303 HydrophobicContact CG-CG2 4.21Å; P285-T303 PolarHBondContact O-OG1 3.27Å; R286-T303 PolarHBondContact O-N 2.54Å; R286-T303 VanDerWaalsContact O-N 3.15Å; A288-T303 HydrophobicContact CB-CG2 3.39Å; A288-T303 VanDerWaalsContact N-CG2 3.27Å; T303-V305 PolarHBondContact OG1-N 3.4Å
304	N	98.3	Very high	96.9	Very high	16 Å²	16	42.2 Å²	42.2	9%	0.086	21%	0.207	C	C	.	.			trans	-121.1	29.9	167.1	71	-31.8	0	0	0	111.4	V321 G322 L324	N304-V321 WeakPolarHBondContact CB-O 3.23Å; N304-V321 PolarHBondContact O-N 2.93Å; N304-G322 PolarHBondContact ND2-O 2.54Å; N304-L324 HydrophobicContact CB-CB 4.46Å; N304-L324 HydrophobicContact CB-CD1 4.05Å
305	V	98.6	Very high	96.8	Very high	6 Å²	6	47.8 Å²	47.8	4%	0.036	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	134.8	-172.1	-179.5	0	0	0	0	110.6	I259 P285 T303 L307 V318 Y320	I259-V305 HydrophobicContact CG2-CG1 4.42Å; P285-V305 WeakPolarHBondContact CD-O 3.33Å; T303-V305 PolarHBondContact OG1-N 3.4Å; V305-L307 HydrophobicContact CG1-CD2 3.58Å; V305-L307 HydrophobicContact CG1-CG 3.94Å; V305-V318 HydrophobicContact CG1-CG1 3.6Å; V305-Y320 HydrophobicContact CG2-CD1 3.95Å; V305-Y320 HydrophobicContact CG2-CE1 3.7Å
306	L	98.9	Very high	97	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	118.6	162.7	171.9	63.8	0	0	0	109.2	F282 L284 R308 T319 V321 I344 I365	F282-L306 HydrophobicContact CB-CD1 4.28Å; F282-L306 HydrophobicContact CD1-CD1 3.79Å; F282-L306 HydrophobicContact CD1-CD2 4.26Å; F282-L306 HydrophobicContact CD1-CG 4.46Å; F282-L306 HydrophobicContact CE1-CD2 4.42Å; F282-L306 HydrophobicContact CG-CD1 4.46Å; L284-L306 HydrophobicContact CD2-CB 3.74Å; L284-L306 HydrophobicContact CD2-CD1 3.72Å; L284-L306 HydrophobicContact CD2-CG 4.31Å; L284-L306 HydrophobicContact CG-CD1 4.12Å; L306-R308 HydrophobicContact CG-CG 4.29Å; L306-T319 PolarHBondContact N-O 3.2Å; L306-T319 PolarHBondContact O-N 3.22Å; L306-V321 HydrophobicContact CB-CG2 3.91Å; L306-I344 HydrophobicContact CD1-CD1 4.41Å; L306-I344 HydrophobicContact CD2-CD1 4.32Å; L306-I365 HydrophobicContact CD2-CB 4.25Å; L306-I365 HydrophobicContact CD2-CG2 4.49Å
307	L	98.9	Very high	97.2	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	130.3	175.1	-57.7	173.1	0	0	0	109.3	L255 I259 M267 F282 F283 P285 V305 V316 A317 V318	L255-L307 HydrophobicContact CB-CD1 3.91Å; L255-L307 HydrophobicContact CD2-CB 4.07Å; L255-L307 HydrophobicContact CD2-CD1 4.03Å; L255-L307 HydrophobicContact CG-CD1 4.49Å; I259-L307 HydrophobicContact CG2-CD2 4.32Å; M267-L307 HydrophobicContact CE-CD1 4.15Å; M267-L307 HydrophobicContact SD-CD1 3.7Å; F282-L307 CarbonylContact C-O 3.56Å; F282-L307 VanDerWaalsContact CA-O 3.31Å; F282-L307 WeakPolarHBondContact CA-O 3.39Å; F283-L307 HydrophobicContact CB-CB 4.25Å; F283-L307 PolarHBondContact N-O 3.41Å; F283-L307 PolarHBondContact O-N 3.15Å; P285-L307 HydrophobicContact CG-CD1 4.38Å; V305-L307 HydrophobicContact CG1-CD2 3.58Å; V305-L307 HydrophobicContact CG1-CG 3.94Å; L307-V316 HydrophobicContact CB-CG1 4.18Å; L307-V316 HydrophobicContact CD2-CG1 4.16Å; L307-A317 WeakPolarHBondContact CA-O 3.39Å; L307-V318 HydrophobicContact CD2-CG1 4.38Å; L307-V318 HydrophobicContact CD2-CG2 3.88Å
308	R	98.7	Very high	97.3	Very high	58 Å²	58	39.1 Å²	39.1	22%	0.219	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	118.8	175.1	-65.3	-180	-66.5	168	-3.4	109.9	W281 F282 L306 V316 A317	W281-R308 CarbonylContact O-C 3.59Å; W281-R308 VanDerWaalsContact O-CA 3.26Å; W281-R308 WeakPolarHBondContact O-CA 3.38Å; F282-R308 HydrophobicContact CD1-CG 3.73Å; F282-R308 HydrophobicContact CD2-CG 4.35Å; F282-R308 HydrophobicContact CE1-CG 3.57Å; F282-R308 HydrophobicContact CE2-CG 4.22Å; F282-R308 HydrophobicContact CG-CG 4.09Å; F282-R308 VanDerWaalsContact CZ-CD 3.48Å; F282-R308 HydrophobicContact CZ-CG 3.82Å; L306-R308 HydrophobicContact CG-CG 4.29Å; R308-V316 CarbonylContact O-C 3.51Å; R308-V316 WeakPolarHBondContact O-CA 3.35Å; R308-A317 HydrophobicContact CB-CB 4.4Å; R308-A317 PolarHBondContact N-O 2.98Å; R308-A317 PolarHBondContact O-N 3.01Å
309	A	98.5	Very high	97.4	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	143.4	-177.9	0	0	0	0	0	110.9	L255 Q280 W281 F313 E315 V316	L255-A309 HydrophobicContact CD2-CB 4.34Å; Q280-A309 CarbonylContact C-O 3.52Å; Q280-A309 WeakPolarHBondContact CA-O 3.43Å; Q280-A309 VanDerWaalsContact CB-O 3.25Å; Q280-A309 WeakPolarHBondContact CB-O 3.45Å; Q280-A309 WeakPolarHBondContact CG-O 3.5Å; W281-A309 HydrophobicContact CB-CB 4.37Å; W281-A309 PolarHBondContact N-O 2.67Å; W281-A309 PolarHBondContact O-N 3.49Å; A309-F313 HydrophobicContact CB-CD1 3.56Å; A309-F313 HydrophobicContact CB-CE1 4.01Å; A309-F313 HydrophobicContact CB-CG 4.21Å; A309-E315 VanDerWaalsContact CA-O 3.32Å; A309-E315 WeakPolarHBondContact CA-O 3.32Å; A309-V316 HydrophobicContact CB-CG2 4.05Å
310	D	96.1	Very high	97.5	Very high	28 Å²	28	43.5 Å²	43.5	15%	0.15	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.7	168.4	165.7	76.7	-40.9	0	0	0	110.7	C312 F313 R314 E315	D310-C312 PolarHBondContact O-N 3.11Å; D310-F313 PolarHBondContact O-N 3.39Å; D310-F313 WeakPolarHBondContact OD1-CA 3.03Å; D310-F313 PolarHBondContact OD1-N 2.8Å; D310-F313 VanDerWaalsContact OD1-N 3.11Å; D310-R314 PolarHBondContact OD1-N 3.43Å; D310-R314 IonicContact OD2-CZ 3.37Å; D310-R314 IonicContact OD2-NE 2.93Å; D310-R314 PolarHBondContact OD2-NE 2.79Å; D310-R314 IonicContact OD2-NH2 2.89Å; D310-R314 PolarHBondContact OD2-NH2 3.46Å; D310-E315 PolarHBondContact N-O 2.9Å; D310-E315 PolarHBondContact OD1-N 3.36Å
311	A	94.2	Very high	97.5	Very high	25 Å²	25	39.9 Å²	39.9	21%	0.207	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-50.7	-29.8	-177.6	0	0	0	0	0	114	I64 W274	I64-A311 HydrophobicContact CD1-CB 4.34Å; I64-A311 WeakPolarHBondContact CD1-O 3.41Å; W274-A311 HydrophobicContact CH2-CB 3.81Å; W274-A311 HydrophobicContact CZ3-CB 4.13Å
312	C	94	Very high	97.4	Very high	23 Å²	23	39.4 Å²	39.4	16%	0.155	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.3	9.9	-176.2	-56.5	0	0	0	0	113.8	C58 D310 R314	C58-C312 HydrophobicContact CB-CB 3.96Å; C58-C312 WeakPolarHBondContact CB-SG 3.05Å; C58-C312 WeakPolarHBondContact SG-CA 2.98Å; C58-C312 WeakPolarHBondContact SG-CB 2.77Å; C58-C312 CovalentContact SG-SG 2.03Å; C58-C312 PolarHBondContact SG-SG 2.67Å; D310-C312 PolarHBondContact O-N 3.11Å; C312-R314 HydrophobicContact CB-CG 3.99Å; C312-R314 PolarHBondContact O-N 2.92Å
313	F	96.4	Very high	97.3	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	24%	0.236	C	C	.	.	S	Bend	trans	51.3	29.9	-177.2	-58.2	-98.5	0	0	0	112.9	Y62 W248 A251 K254 L255 W281 F283 A309 D310	Y62-F313 HydrophobicContact CD2-CD2 4.19Å; Y62-F313 HydrophobicContact CE1-CD2 4.41Å; Y62-F313 AromaticContact CE2-CD2 3.88Å; Y62-F313 HydrophobicContact CE2-CD2 3.88Å; Y62-F313 AromaticContact CZ-CD2 3.98Å; W248-F313 HydrophobicContact CE3-CE2 4.43Å; W248-F313 HydrophobicContact CE3-CZ 4.11Å; W248-F313 HydrophobicContact CH2-CZ 4.33Å; W248-F313 HydrophobicContact CZ3-CE2 4.26Å; W248-F313 AromaticContact CZ3-CZ 3.78Å; W248-F313 HydrophobicContact CZ3-CZ 3.78Å; A251-F313 HydrophobicContact CB-CB 4.33Å; A251-F313 HydrophobicContact CB-CD1 3.8Å; A251-F313 HydrophobicContact CB-CD2 3.53Å; A251-F313 HydrophobicContact CB-CE1 3.9Å; A251-F313 HydrophobicContact CB-CE2 3.64Å; A251-F313 HydrophobicContact CB-CG 3.62Å; A251-F313 HydrophobicContact CB-CZ 3.83Å; K254-F313 HydrophobicContact CD-CB 4.21Å; K254-F313 WeakPolarHBondContact CD-O 3.46Å; K254-F313 WeakPolarHBondContact CE-O 3.44Å; K254-F313 PolarHBondContact NZ-O 2.87Å; L255-F313 HydrophobicContact CD1-CE1 4.15Å; L255-F313 HydrophobicContact CD2-CD1 4.13Å; L255-F313 HydrophobicContact CD2-CE1 4.2Å; L255-F313 HydrophobicContact CG-CD1 4.19Å; L255-F313 HydrophobicContact CG-CE1 4.24Å; W281-F313 HydrophobicContact CB-CE1 4.36Å; W281-F313 HydrophobicContact CB-CZ 4.3Å; W281-F313 AromaticContact CD1-CE2 3.69Å; W281-F313 AromaticContact CD1-CZ 3.54Å; W281-F313 HydrophobicContact CD2-CZ 4.44Å; W281-F313 HydrophobicContact CG-CE1 4.39Å; W281-F313 HydrophobicContact CG-CE2 4.44Å; W281-F313 AromaticContact CG-CZ 3.85Å; W281-F313 HydrophobicContact CG-CZ 3.85Å; W281-F313 AromaticContact NE1-CE2 3.88Å; W281-F313 AromaticContact NE1-CZ 3.97Å; F283-F313 AromaticContact CE2-CE1 3.71Å; F283-F313 HydrophobicContact CE2-CE1 3.71Å; F283-F313 HydrophobicContact CE2-CZ 4.07Å; F283-F313 HydrophobicContact CZ-CE1 4.28Å; F283-F313 HydrophobicContact CZ-CZ 4.39Å; A309-F313 HydrophobicContact CB-CD1 3.56Å; A309-F313 HydrophobicContact CB-CE1 4.01Å; A309-F313 HydrophobicContact CB-CG 4.21Å; D310-F313 PolarHBondContact O-N 3.39Å; D310-F313 WeakPolarHBondContact OD1-CA 3.03Å; D310-F313 PolarHBondContact OD1-N 2.8Å; D310-F313 VanDerWaalsContact OD1-N 3.11Å
314	R	93.8	Very high	97.3	Very high	181 Å²	181	48.4 Å²	48.4	68%	0.683	26%	0.257	S	S	*	.	S	Bend	trans	-74.2	-36.7	177.3	-68.3	174.9	-64.9	177.6	2	111.1	D310 C312	D310-R314 PolarHBondContact OD1-N 3.43Å; D310-R314 IonicContact OD2-CZ 3.37Å; D310-R314 IonicContact OD2-NE 2.93Å; D310-R314 PolarHBondContact OD2-NE 2.79Å; D310-R314 IonicContact OD2-NH2 2.89Å; D310-R314 PolarHBondContact OD2-NH2 3.46Å; C312-R314 HydrophobicContact CB-CG 3.99Å; C312-R314 PolarHBondContact O-N 2.92Å
315	E	94.5	Very high	97.2	Very high	155 Å²	155	49.2 Å²	49.2	72%	0.724	26%	0.264	S	S	*	.			trans	-125.1	131.1	177.1	-66.6	179.1	-172.9	0	0	108.7	A309 D310	A309-E315 VanDerWaalsContact CA-O 3.32Å; A309-E315 WeakPolarHBondContact CA-O 3.32Å; D310-E315 PolarHBondContact N-O 2.9Å; D310-E315 PolarHBondContact OD1-N 3.36Å
316	V	98.5	Very high	97.2	Very high	34 Å²	34	53.8 Å²	53.8	21%	0.206	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	113.4	177.3	-176.2	0	0	0	0	108.1	L255 A258 L307 R308 A309	L255-V316 HydrophobicContact CD2-CG1 4.09Å; L255-V316 HydrophobicContact CD2-CG2 4.37Å; A258-V316 HydrophobicContact CB-CB 3.74Å; A258-V316 HydrophobicContact CB-CG1 3.59Å; L307-V316 HydrophobicContact CB-CG1 4.18Å; L307-V316 HydrophobicContact CD2-CG1 4.16Å; R308-V316 CarbonylContact O-C 3.51Å; R308-V316 WeakPolarHBondContact O-CA 3.35Å; A309-V316 HydrophobicContact CB-CG2 4.05Å
317	A	98.5	Very high	97.2	Very high	40 Å²	40	54.9 Å²	54.9	33%	0.331	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	144.1	172.4	0	0	0	0	0	110.4	L307 R308	L307-A317 WeakPolarHBondContact CA-O 3.39Å; R308-A317 HydrophobicContact CB-CB 4.4Å; R308-A317 PolarHBondContact N-O 2.98Å; R308-A317 PolarHBondContact O-N 3.01Å
318	V	98.7	Very high	97.1	Very high	47 Å²	47	58.1 Å²	58.1	29%	0.285	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	124.8	-176.5	-174.7	0	0	0	0	108.8	A258 I259 V305 L307 Y320	A258-V318 HydrophobicContact CB-CG2 3.98Å; I259-V318 HydrophobicContact CG2-CB 4.45Å; I259-V318 HydrophobicContact CG2-CG1 3.71Å; I259-V318 HydrophobicContact CG2-CG2 3.84Å; V305-V318 HydrophobicContact CG1-CG1 3.6Å; L307-V318 HydrophobicContact CD2-CG1 4.38Å; L307-V318 HydrophobicContact CD2-CG2 3.88Å; V318-Y320 HydrophobicContact CG1-CE2 4.14Å
319	T	98.7	Very high	97.1	Very high	20 Å²	20	55.3 Å²	55.3	12%	0.123	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	136.1	170.7	-58.5	0	0	0	0	108.6	L306	L306-T319 PolarHBondContact N-O 3.2Å; L306-T319 PolarHBondContact O-N 3.22Å
320	Y	98.5	Very high	97.1	Very high	144 Å²	144	55.3 Å²	55.3	57%	0.565	30%	0.296	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.5	131.2	172.3	-67	-89.3	0	0	0	110	V305 V318 G367	V305-Y320 HydrophobicContact CG2-CD1 3.95Å; V305-Y320 HydrophobicContact CG2-CE1 3.7Å; V318-Y320 HydrophobicContact CG1-CE2 4.14Å; Y320-G367 WeakPolarHBondContact O-CA 3.22Å
321	V	98.5	Very high	97.2	Very high	1 Å²	1	54 Å²	54	1%	0.006	29%	0.289	C	S	.	.			trans	-104	105.6	-173.5	179.9	0	0	0	0	109.5	N304 L306 F330 F363 I369	N304-V321 WeakPolarHBondContact CB-O 3.23Å; N304-V321 PolarHBondContact O-N 2.93Å; L306-V321 HydrophobicContact CB-CG2 3.91Å; V321-F330 HydrophobicContact CB-CZ 4.32Å; V321-F330 HydrophobicContact CG1-CZ 4.25Å; V321-F363 HydrophobicContact CB-CD2 4.31Å; V321-F363 HydrophobicContact CB-CE2 4.36Å; V321-F363 HydrophobicContact CG1-CB 3.89Å; V321-F363 HydrophobicContact CG1-CD1 3.67Å; V321-F363 HydrophobicContact CG1-CD2 3.43Å; V321-F363 VanDerWaalsContact CG1-CD2 3.43Å; V321-F363 HydrophobicContact CG1-CE1 3.98Å; V321-F363 HydrophobicContact CG1-CE2 3.77Å; V321-F363 HydrophobicContact CG1-CG 3.38Å; V321-F363 HydrophobicContact CG1-CZ 4.03Å; V321-F363 HydrophobicContact CG2-CD2 3.85Å; V321-F363 HydrophobicContact CG2-CE2 3.63Å; V321-F363 HydrophobicContact CG2-CZ 4.24Å; V321-I369 HydrophobicContact CG1-CD1 3.7Å
322	G	96.6	Very high	97.5	Very high	34 Å²	34	52.8 Å²	52.8	35%	0.351	28%	0.279	S	S	.	.	S	Bend	trans	52.8	-152.8	-177.7	0	0	0	0	0	114	N304 G367	N304-G322 PolarHBondContact ND2-O 2.54Å; G322-G367 PolarHBondContact N-O 3.42Å
323	S	96.1	Very high	97.7	Very high	112 Å²	112	51.8 Å²	51.8	78%	0.783	27%	0.272	S	S	*	.	S	Bend	trans	-85.2	142.8	179.4	-59.2	0	0	0	0	111.9	S325	S323-S325 PolarHBondContact O-N 2.93Å
324	L	97.8	Very high	97.8	Very high	92 Å²	92	52 Å²	52	48%	0.482	27%	0.273	S	S	.	.	P	Polyproline II helix	trans	-70	125.5	175.3	180	64.6	0	0	0	111	A302 N304 L326	A302-L324 WeakPolarHBondContact O-CD1 3.3Å; N304-L324 HydrophobicContact CB-CB 4.46Å; N304-L324 HydrophobicContact CB-CD1 4.05Å; L324-L326 HydrophobicContact CD2-CD2 3.91Å; L324-L326 HydrophobicContact CG-CD2 4.28Å
325	S	97.9	Very high	98	Very high	34 Å²	34	44.5 Å²	44.5	24%	0.238	25%	0.245	C	C	.	.	P	Polyproline II helix	trans	-97.6	137	156.2	174.4	0	0	0	0	107.9	A302 S323 T327 R328	A302-S325 WeakPolarHBondContact CB-O 3.16Å; S323-S325 PolarHBondContact O-N 2.93Å; S325-T327 PolarHBondContact O-N 2.84Å; S325-T327 PolarHBondContact OG-N 3.02Å; S325-T327 PolarHBondContact OG-OG1 2.77Å; S325-R328 PolarHBondContact OG-N 2.9Å
326	L	97.7	Very high	98.2	Very high	101 Å²	101	37.1 Å²	37.1	53%	0.529	21%	0.211	S	C	.	.	S	Bend	trans	-75.4	-17.4	178.3	-63.4	-179.1	0	0	0	112.5	H300 R301 A302 L324	H300-L326 CarbonylContact C-O 3.46Å; H300-L326 WeakPolarHBondContact CA-O 3.37Å; R301-L326 PolarHBondContact N-O 2.81Å; A302-L326 VanDerWaalsContact CB-C 3.48Å; A302-L326 VanDerWaalsContact CB-O 3.23Å; A302-L326 WeakPolarHBondContact CB-O 3.47Å; A302-L326 PolarHBondContact N-O 3.38Å; L324-L326 HydrophobicContact CD2-CD2 3.91Å; L324-L326 HydrophobicContact CG-CD2 4.28Å
327	T	98	Very high	98	Very high	24 Å²	24	38.2 Å²	38.2	15%	0.147	22%	0.219	C	C	.	.	S	Bend	trans	-114.5	-24.8	-168.2	52.9	0	0	0	0	113.4	R287 E299 S325 E350 I352	R287-T327 PolarHBondContact NH1-O 3.48Å; E299-T327 WeakPolarHBondContact O-CA 3.29Å; S325-T327 PolarHBondContact O-N 2.84Å; S325-T327 PolarHBondContact OG-N 3.02Å; S325-T327 PolarHBondContact OG-OG1 2.77Å; T327-E350 VanDerWaalsContact CB-OE1 3.25Å; T327-E350 WeakPolarHBondContact CB-OE1 3.45Å; T327-E350 PolarHBondContact OG1-OE1 3.1Å; T327-I352 HydrophobicContact CG2-CD1 3.36Å; T327-I352 HydrophobicContact CG2-CG1 4.01Å
328	R	98.1	Very high	97.7	Very high	67 Å²	67	41.8 Å²	41.8	25%	0.253	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	100.2	-178.4	-58.7	176.2	-175.1	-176.6	-4.6	111.1	A302 S325 K348 E350 Y359 D373	A302-R328 VanDerWaalsContact CB-C 3.43Å; A302-R328 WeakPolarHBondContact CB-O 3.46Å; S325-R328 PolarHBondContact OG-N 2.9Å; R328-K348 HydrophobicContact CB-CB 4.29Å; R328-K348 HydrophobicContact CB-CD 4.15Å; R328-E350 HydrophobicContact CG-CB 4.07Å; R328-E350 HydrophobicContact CG-CG 4.39Å; R328-E350 WeakPolarHBondContact CG-OE1 3.3Å; R328-E350 IonicContact NE-OE1 2.73Å; R328-Y359 HydrophobicContact CG-CD2 4.23Å; R328-Y359 HydrophobicContact CG-CE2 4.06Å; R328-Y359 PolarHBondContact NH2-OH 3.44Å; R328-D373 WeakPolarHBondContact CD-OD2 3.31Å; R328-D373 IonicContact CZ-OD2 3.91Å; R328-D373 IonicContact NE-OD2 3.54Å; R328-D373 IonicContact NH1-OD2 3.53Å; R328-D373 PolarHBondContact NH1-OD2 3.37Å
329	G	98.3	Very high	97.6	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	149.5	179.3	0	0	0	0	0	112.1	R286 S331 K348 S349	R286-G329 VanDerWaalsContact O-CA 3.31Å; R286-G329 WeakPolarHBondContact O-CA 3.15Å; G329-S331 PolarHBondContact O-N 3.48Å; G329-K348 CarbonylContact O-C 3.57Å; G329-K348 WeakPolarHBondContact O-CA 3.44Å; G329-K348 WeakPolarHBondContact O-CB 3.25Å; G329-S349 PolarHBondContact N-O 3.43Å; G329-S349 PolarHBondContact O-N 3.26Å
330	F	98.8	Very high	97.4	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	125.7	175.9	-65.7	-74.4	0	0	0	111.7	L284 R286 V321 A346 V347 K348 T361 F363	L284-F330 HydrophobicContact CB-CB 3.59Å; L284-F330 HydrophobicContact CB-CD1 4.27Å; L284-F330 HydrophobicContact CB-CD2 3.73Å; L284-F330 HydrophobicContact CB-CE2 4.39Å; L284-F330 HydrophobicContact CB-CG 3.63Å; L284-F330 HydrophobicContact CD1-CD1 4Å; L284-F330 HydrophobicContact CD1-CE1 4.27Å; L284-F330 HydrophobicContact CD1-CG 4.21Å; L284-F330 HydrophobicContact CD2-CD2 4.14Å; L284-F330 HydrophobicContact CD2-CE1 4.49Å; L284-F330 HydrophobicContact CD2-CE2 3.95Å; L284-F330 HydrophobicContact CD2-CG 4.46Å; L284-F330 HydrophobicContact CD2-CZ 4.15Å; L284-F330 HydrophobicContact CG-CD2 4.41Å; L284-F330 HydrophobicContact CG-CG 4.34Å; R286-F330 VanDerWaalsContact CA-O 3.24Å; R286-F330 WeakPolarHBondContact CA-O 3.37Å; R286-F330 VanDerWaalsContact CB-O 3.23Å; R286-F330 WeakPolarHBondContact CB-O 3.42Å; R286-F330 PolarHBondContact N-O 2.71Å; V321-F330 HydrophobicContact CB-CZ 4.32Å; V321-F330 HydrophobicContact CG1-CZ 4.25Å; F330-A346 HydrophobicContact CD1-CB 3.9Å; F330-A346 HydrophobicContact CE1-CB 4.07Å; F330-V347 WeakPolarHBondContact CA-O 3.31Å; F330-K348 HydrophobicContact CD1-CD 4.35Å; F330-K348 HydrophobicContact CD1-CG 3.63Å; F330-K348 HydrophobicContact CE1-CD 4.21Å; F330-K348 HydrophobicContact CE1-CG 3.95Å; F330-K348 HydrophobicContact CG-CG 4.24Å; F330-T361 HydrophobicContact CE1-CG2 4.17Å; F330-F363 AromaticContact CE1-CE1 3.78Å; F330-F363 HydrophobicContact CE1-CE1 3.78Å; F330-F363 HydrophobicContact CE1-CZ 4.11Å; F330-F363 HydrophobicContact CZ-CE1 4.21Å; F330-F363 HydrophobicContact CZ-CZ 4.28Å
331	S	98.4	Very high	97.4	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	-35	179.1	54.7	0	0	0	0	113	E270 G329 V347 F382 E383	E270-S331 CarbonylContact C-O 3.56Å; E270-S331 VanDerWaalsContact C-O 3.26Å; G329-S331 PolarHBondContact O-N 3.48Å; S331-V347 PolarHBondContact N-O 3Å; S331-V347 WeakPolarHBondContact OG-CG1 3.38Å; S331-V347 PolarHBondContact OG-O 3.12Å; S331-F382 PolarHBondContact OG-O 3.14Å; S331-E383 CarbonylContact C-O 3.57Å
332	A	98.8	Very high	97.4	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	163.7	169.4	0	0	0	0	0	112.6	A346 V347 E383 I385	A332-A346 CarbonylContact O-C 3.57Å; A332-A346 VanDerWaalsContact O-CA 3.24Å; A332-A346 WeakPolarHBondContact O-CA 3.46Å; A332-A346 WeakPolarHBondContact O-CB 3.36Å; A332-V347 PolarHBondContact N-O 2.82Å; A332-V347 PolarHBondContact O-N 2.8Å; A332-E383 WeakPolarHBondContact CB-O 3.2Å; A332-I385 HydrophobicContact CB-CB 4.45Å; A332-I385 HydrophobicContact CB-CG2 3.61Å
333	F	98.9	Very high	97.5	Very high	1 Å²	1	36.5 Å²	36.5	0%	0.004	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.7	159.8	166.6	78.9	-85.6	0	0	0	113.4	S271 Q273 F282 L284 F335 I344 V345 A346	S271-F333 WeakPolarHBondContact OG-CD1 3.36Å; Q273-F333 HydrophobicContact CB-CD2 4.46Å; Q273-F333 HydrophobicContact CB-CE1 4.35Å; Q273-F333 HydrophobicContact CB-CE2 3.52Å; Q273-F333 HydrophobicContact CB-CZ 3.44Å; Q273-F333 VanDerWaalsContact CB-CZ 3.44Å; Q273-F333 HydrophobicContact CG-CD1 4.46Å; Q273-F333 HydrophobicContact CG-CD2 3.91Å; Q273-F333 HydrophobicContact CG-CE1 4.04Å; Q273-F333 HydrophobicContact CG-CE2 3.42Å; Q273-F333 VanDerWaalsContact CG-CE2 3.42Å; Q273-F333 HydrophobicContact CG-CG 4.41Å; Q273-F333 HydrophobicContact CG-CZ 3.49Å; Q273-F333 VanDerWaalsContact CG-CZ 3.49Å; Q273-F333 WeakPolarHBondContact CG-O 3.45Å; Q273-F333 PolarHBondContact NE2-O 3.1Å; F282-F333 HydrophobicContact CB-CE2 4.15Å; F282-F333 HydrophobicContact CB-CZ 3.66Å; F282-F333 WeakPolarHBondContact O-CZ 3.39Å; L284-F333 HydrophobicContact CB-CD1 4.39Å; L284-F333 HydrophobicContact CD1-CB 3.71Å; L284-F333 HydrophobicContact CD1-CD1 3.48Å; L284-F333 VanDerWaalsContact CD1-CD1 3.48Å; L284-F333 HydrophobicContact CD1-CD2 4.35Å; L284-F333 HydrophobicContact CD1-CE1 4.15Å; L284-F333 HydrophobicContact CD1-CG 3.59Å; L284-F333 HydrophobicContact CG-CD1 4.03Å; L284-F333 HydrophobicContact CG-CE1 4.25Å; F333-F335 HydrophobicContact CE2-CE1 4.35Å; F333-F335 HydrophobicContact CE2-CE2 4.41Å; F333-F335 HydrophobicContact CE2-CZ 4.13Å; F333-I344 HydrophobicContact CB-CG2 3.7Å; F333-I344 HydrophobicContact CD2-CD1 4.26Å; F333-I344 HydrophobicContact CD2-CG1 4.27Å; F333-I344 HydrophobicContact CD2-CG2 3.64Å; F333-I344 HydrophobicContact CE2-CD1 4.27Å; F333-I344 HydrophobicContact CG-CG2 3.99Å; F333-V345 CarbonylContact C-O 3.4Å; F333-V345 WeakPolarHBondContact CA-O 3.35Å; F333-V345 WeakPolarHBondContact CB-O 3.36Å; F333-A346 HydrophobicContact CB-CB 3.71Å
334	Q	98.8	Very high	97.6	Very high	6 Å²	6	31.2 Å²	31.2	3%	0.028	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	153.1	168.4	-63.1	-60.6	-19.6	0	0	110.8	L155 I344 V345 I385 L387	L155-Q334 PolarHBondContact O-NE2 2.87Å; Q334-I344 WeakPolarHBondContact O-CA 3.36Å; Q334-V345 HydrophobicContact CB-CG1 4.2Å; Q334-V345 PolarHBondContact N-O 3.42Å; Q334-V345 PolarHBondContact O-N 2.89Å; Q334-I385 HydrophobicContact CG-CG2 4.21Å; Q334-I385 VanDerWaalsContact CG-O 3.26Å; Q334-I385 WeakPolarHBondContact CG-O 3.44Å; Q334-I385 PolarHBondContact NE2-O 2.87Å; Q334-L387 HydrophobicContact CB-CD1 3.38Å; Q334-L387 HydrophobicContact CG-CD1 3.98Å
335	F	98.6	Very high	97.6	Very high	22 Å²	22	26.8 Å²	26.8	10%	0.096	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	134.7	165.7	-62.9	-67.3	0	0	0	109.7	Q273 F282 F333 P337 D341 I344	Q273-F335 HydrophobicContact CB-CD2 4.28Å; Q273-F335 HydrophobicContact CB-CE2 3.66Å; Q273-F335 HydrophobicContact CB-CZ 4.32Å; F282-F335 HydrophobicContact CB-CZ 4.03Å; F282-F335 AromaticContact CD1-CE1 3.86Å; F282-F335 HydrophobicContact CD1-CE1 3.86Å; F282-F335 AromaticContact CD1-CZ 3.83Å; F282-F335 HydrophobicContact CD1-CZ 3.83Å; F282-F335 HydrophobicContact CD2-CE1 4.49Å; F282-F335 AromaticContact CD2-CZ 3.75Å; F282-F335 HydrophobicContact CD2-CZ 3.75Å; F282-F335 HydrophobicContact CE1-CE1 4.02Å; F282-F335 HydrophobicContact CE1-CZ 4.22Å; F282-F335 HydrophobicContact CE2-CZ 4.14Å; F282-F335 HydrophobicContact CG-CE1 4.14Å; F282-F335 AromaticContact CG-CZ 3.62Å; F282-F335 HydrophobicContact CG-CZ 3.62Å; F282-F335 HydrophobicContact CZ-CE1 4.42Å; F282-F335 HydrophobicContact CZ-CZ 4.38Å; F333-F335 HydrophobicContact CE2-CE1 4.35Å; F333-F335 HydrophobicContact CE2-CE2 4.41Å; F333-F335 HydrophobicContact CE2-CZ 4.13Å; F335-P337 WeakPolarHBondContact O-CD 3.41Å; F335-D341 HydrophobicContact CB-CB 4.25Å; F335-D341 HydrophobicContact CD1-CB 3.67Å; F335-D341 HydrophobicContact CD2-CB 4.3Å; F335-D341 HydrophobicContact CE1-CB 4.03Å; F335-D341 HydrophobicContact CG-CB 3.81Å; F335-D341 HydrophobicContact CZ-CB 4.5Å; F335-I344 HydrophobicContact CD1-CD1 4.41Å; F335-I344 HydrophobicContact CD1-CG1 3.78Å; F335-I344 HydrophobicContact CE1-CD1 4.04Å; F335-I344 HydrophobicContact CE1-CG1 3.93Å
336	I	98	Very high	97.7	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	15%	0.145	C	C	.	.	P	Polyproline II helix	trans	-73.9	125.1	176.5	-57.3	175.2	0	0	0	108.7	Y89 L119 L121 T339 L343 V345 V362	Y89-I336 HydrophobicContact CD1-CG2 4.34Å; Y89-I336 HydrophobicContact CD2-CG2 4.13Å; Y89-I336 HydrophobicContact CE1-CG2 3.98Å; Y89-I336 HydrophobicContact CE2-CG2 3.76Å; Y89-I336 HydrophobicContact CG-CG2 4.41Å; L119-I336 HydrophobicContact CD2-CD1 3.82Å; L119-I336 HydrophobicContact CD2-CG1 4.19Å; L121-I336 HydrophobicContact CD1-CD1 4.29Å; L121-I336 HydrophobicContact CD1-CG2 3.84Å; L121-I336 HydrophobicContact CD2-CD1 4.06Å; I336-T339 HydrophobicContact CB-CG2 3.94Å; I336-T339 HydrophobicContact CG2-CG2 3.98Å; I336-T339 WeakPolarHBondContact O-CB 3.36Å; I336-T339 WeakPolarHBondContact O-CG2 3.04Å; I336-T339 PolarHBondContact O-N 3.25Å; I336-T339 PolarHBondContact O-OG1 3.26Å; I336-L343 HydrophobicContact CB-CB 4.36Å; I336-L343 HydrophobicContact CD1-CB 4.05Å; I336-L343 HydrophobicContact CG1-CB 4.43Å; I336-L343 PolarHBondContact N-O 2.83Å; I336-V345 HydrophobicContact CD1-CB 4.28Å; I336-V345 HydrophobicContact CG1-CB 4.11Å; I336-V345 HydrophobicContact CG1-CG1 4.12Å; I336-V362 HydrophobicContact CD1-CG1 3.65Å
337	P	95.1	Very high	97.7	Very high	57 Å²	57	20.4 Å²	20.4	37%	0.37	12%	0.12	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.1	151.3	-177.8	-27.1	35.1	0	0	0	113.3	Y89 F335 T339 L387	Y89-P337 HydrophobicContact CD1-CG 4.32Å; Y89-P337 HydrophobicContact CE1-CB 4.13Å; Y89-P337 HydrophobicContact CE1-CG 4.33Å; Y89-P337 PolarHBondContact OH-O 2.73Å; F335-P337 WeakPolarHBondContact O-CD 3.41Å; P337-T339 PolarHBondContact O-N 2.71Å; P337-L387 HydrophobicContact CG-CD2 4.36Å
338	L	91.7	Very high	97.8	Very high	116 Å²	116	19.7 Å²	19.7	61%	0.607	12%	0.115	S	C	*	.	T	Hydrogen-bonded Turn	trans	64	4.4	179.2	-48.7	174.2	0	0	0	115	R85 G340	R85-L338 HydrophobicContact CG-CD1 4.19Å; R85-L338 VanDerWaalsContact NH2-C 3.31Å; R85-L338 PolarHBondContact NH2-O 3.19Å; L338-G340 VanDerWaalsContact C-N 3.34Å
339	T	95.4	Very high	97.8	Very high	13 Å²	13	16.5 Å²	16.5	8%	0.08	10%	0.103	C	C	.	.	S	Bend	trans	-91.2	4.1	176.1	70.8	0	0	0	0	113.3	L121 I336 P337 D341 S342 L343	L121-T339 HydrophobicContact CD1-CG2 4.2Å; I336-T339 HydrophobicContact CB-CG2 3.94Å; I336-T339 HydrophobicContact CG2-CG2 3.98Å; I336-T339 WeakPolarHBondContact O-CB 3.36Å; I336-T339 WeakPolarHBondContact O-CG2 3.04Å; I336-T339 PolarHBondContact O-N 3.25Å; I336-T339 PolarHBondContact O-OG1 3.26Å; P337-T339 PolarHBondContact O-N 2.71Å; T339-D341 PolarHBondContact O-N 2.9Å; T339-S342 WeakPolarHBondContact O-CB 3.3Å; T339-S342 PolarHBondContact O-N 3.03Å; T339-S342 PolarHBondContact O-OG 2.82Å; T339-L343 HydrophobicContact CG2-CB 4.05Å; T339-L343 HydrophobicContact CG2-CD1 3.88Å; T339-L343 HydrophobicContact CG2-CG 4.1Å; T339-L343 PolarHBondContact OG1-N 2.71Å
340	G	95.7	Very high	97.7	Very high	39 Å²	39	18 Å²	18	40%	0.402	11%	0.109	S	C	.	.	T	Hydrogen-bonded Turn	trans	62.7	32.9	-173.1	0	0	0	0	0	112.5	H278 L338 S342	H278-G340 PolarHBondContact NE2-O 3.22Å; L338-G340 VanDerWaalsContact C-N 3.34Å; G340-S342 PolarHBondContact O-N 3.27Å
341	D	97.9	Very high	97.5	Very high	28 Å²	28	19.9 Å²	19.9	15%	0.15	12%	0.118	C	C	.	.	T	Hydrogen-bonded Turn	trans	55	30	-175.3	-53.3	-4.7	0	0	0	112.4	S275 R277 H278 F335 T339 I365	S275-D341 WeakPolarHBondContact CB-OD2 3.35Å; S275-D341 PolarHBondContact OG-OD2 3.07Å; R277-D341 HydrophobicContact CB-CB 4.24Å; R277-D341 WeakPolarHBondContact CB-OD2 3.21Å; R277-D341 HydrophobicContact CG-CB 4.38Å; R277-D341 WeakPolarHBondContact CG-OD2 3.43Å; H278-D341 PolarHBondContact NE2-O 3.25Å; F335-D341 HydrophobicContact CB-CB 4.25Å; F335-D341 HydrophobicContact CD1-CB 3.67Å; F335-D341 HydrophobicContact CD2-CB 4.3Å; F335-D341 HydrophobicContact CE1-CB 4.03Å; F335-D341 HydrophobicContact CG-CB 3.81Å; F335-D341 HydrophobicContact CZ-CB 4.5Å; T339-D341 PolarHBondContact O-N 2.9Å; D341-I365 WeakPolarHBondContact O-CG2 3.45Å
342	S	98	Very high	97.3	Very high	48 Å²	48	22.4 Å²	22.4	34%	0.336	13%	0.131	S	C	.	.			trans	-93	-19.8	178.2	68	0	0	0	0	113.1	T339 G340 G364 I365	T339-S342 WeakPolarHBondContact O-CB 3.3Å; T339-S342 PolarHBondContact O-N 3.03Å; T339-S342 PolarHBondContact O-OG 2.82Å; G340-S342 PolarHBondContact O-N 3.27Å; S342-G364 CarbonylContact O-C 3.52Å; S342-G364 VanDerWaalsContact O-CA 3.26Å; S342-G364 WeakPolarHBondContact O-CA 3.5Å; S342-I365 PolarHBondContact O-N 2.81Å
343	L	98.5	Very high	97	Very high	7 Å²	7	25.6 Å²	25.6	4%	0.037	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	140.9	175.2	-57.8	-176.2	0	0	0	110.9	L121 M125 I336 T339 L370	L121-L343 HydrophobicContact CD1-CD1 3.95Å; L121-L343 HydrophobicContact CD2-CD1 4.5Å; M125-L343 HydrophobicContact CB-CD1 4.14Å; I336-L343 HydrophobicContact CB-CB 4.36Å; I336-L343 HydrophobicContact CD1-CB 4.05Å; I336-L343 HydrophobicContact CG1-CB 4.43Å; I336-L343 PolarHBondContact N-O 2.83Å; T339-L343 HydrophobicContact CG2-CB 4.05Å; T339-L343 HydrophobicContact CG2-CD1 3.88Å; T339-L343 HydrophobicContact CG2-CG 4.1Å; T339-L343 PolarHBondContact OG1-N 2.71Å; L343-L370 HydrophobicContact CD1-CD2 3.68Å; L343-L370 HydrophobicContact CD2-CD1 4.12Å; L343-L370 HydrophobicContact CD2-CD2 3.75Å; L343-L370 HydrophobicContact CG-CD2 4.35Å
344	I	98.8	Very high	96.5	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	135.2	-179.4	-69.7	171	0	0	0	108.5	F282 L284 L306 F333 Q334 F335 A346 V362 F363 I365	F282-I344 HydrophobicContact CD1-CD1 4.31Å; L284-I344 HydrophobicContact CD1-CG2 4.37Å; L306-I344 HydrophobicContact CD1-CD1 4.41Å; L306-I344 HydrophobicContact CD2-CD1 4.32Å; F333-I344 HydrophobicContact CB-CG2 3.7Å; F333-I344 HydrophobicContact CD2-CD1 4.26Å; F333-I344 HydrophobicContact CD2-CG1 4.27Å; F333-I344 HydrophobicContact CD2-CG2 3.64Å; F333-I344 HydrophobicContact CE2-CD1 4.27Å; F333-I344 HydrophobicContact CG-CG2 3.99Å; Q334-I344 WeakPolarHBondContact O-CA 3.36Å; F335-I344 HydrophobicContact CD1-CD1 4.41Å; F335-I344 HydrophobicContact CD1-CG1 3.78Å; F335-I344 HydrophobicContact CE1-CD1 4.04Å; F335-I344 HydrophobicContact CE1-CG1 3.93Å; I344-A346 HydrophobicContact CG2-CB 4.22Å; I344-V362 WeakPolarHBondContact O-CA 3.42Å; I344-F363 HydrophobicContact CB-CD2 4.42Å; I344-F363 HydrophobicContact CB-CE1 4.46Å; I344-F363 HydrophobicContact CB-CE2 4.01Å; I344-F363 HydrophobicContact CB-CZ 4.04Å; I344-F363 HydrophobicContact CD1-CE2 3.99Å; I344-F363 HydrophobicContact CD1-CZ 4.41Å; I344-F363 HydrophobicContact CG2-CE1 4Å; I344-F363 HydrophobicContact CG2-CE2 4.14Å; I344-F363 HydrophobicContact CG2-CZ 3.66Å; I344-F363 PolarHBondContact N-O 2.87Å; I344-F363 PolarHBondContact O-N 3.01Å; I344-I365 HydrophobicContact CD1-CG2 3.94Å; I344-I365 HydrophobicContact CG1-CG2 4.32Å
345	V	98.9	Very high	96.3	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	129.4	160.2	59.8	0	0	0	0	107.9	L119 F333 Q334 I336 L360 V362 I385 L387	L119-V345 HydrophobicContact CD2-CB 4.07Å; L119-V345 HydrophobicContact CD2-CG1 4.42Å; L119-V345 HydrophobicContact CD2-CG2 4.14Å; F333-V345 CarbonylContact C-O 3.4Å; F333-V345 WeakPolarHBondContact CA-O 3.35Å; F333-V345 WeakPolarHBondContact CB-O 3.36Å; Q334-V345 HydrophobicContact CB-CG1 4.2Å; Q334-V345 PolarHBondContact N-O 3.42Å; Q334-V345 PolarHBondContact O-N 2.89Å; I336-V345 HydrophobicContact CD1-CB 4.28Å; I336-V345 HydrophobicContact CG1-CB 4.11Å; I336-V345 HydrophobicContact CG1-CG1 4.12Å; V345-L360 HydrophobicContact CG2-CD1 3.78Å; V345-L360 HydrophobicContact CG2-CD2 3.89Å; V345-L360 HydrophobicContact CG2-CG 3.85Å; V345-V362 HydrophobicContact CB-CG2 4.3Å; V345-V362 HydrophobicContact CG2-CG2 4.14Å; V345-I385 HydrophobicContact CG1-CD1 4.17Å; V345-I385 HydrophobicContact CG2-CD1 3.75Å; V345-L387 HydrophobicContact CG1-CD1 4.17Å
346	A	98.9	Very high	96.2	Very high	0 Å²	0	35 Å²	35	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	150.6	-177.2	0	0	0	0	0	111.8	L284 F330 A332 F333 I344 L360 T361 F363	L284-A346 HydrophobicContact CD1-CB 4.12Å; F330-A346 HydrophobicContact CD1-CB 3.9Å; F330-A346 HydrophobicContact CE1-CB 4.07Å; A332-A346 CarbonylContact O-C 3.57Å; A332-A346 VanDerWaalsContact O-CA 3.24Å; A332-A346 WeakPolarHBondContact O-CA 3.46Å; A332-A346 WeakPolarHBondContact O-CB 3.36Å; F333-A346 HydrophobicContact CB-CB 3.71Å; I344-A346 HydrophobicContact CG2-CB 4.22Å; A346-L360 WeakPolarHBondContact O-CA 3.28Å; A346-T361 HydrophobicContact CB-CG2 4.11Å; A346-T361 PolarHBondContact N-O 3.5Å; A346-T361 PolarHBondContact O-N 2.81Å; A346-F363 HydrophobicContact CB-CE1 3.78Å; A346-F363 HydrophobicContact CB-CZ 4.36Å
347	V	98.9	Very high	96.2	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	135.8	168.3	-176.1	0	0	0	0	108.1	V93 F330 S331 A332 Y359 I376 F382 I385	V93-V347 HydrophobicContact CG1-CG2 3.86Å; F330-V347 WeakPolarHBondContact CA-O 3.31Å; S331-V347 PolarHBondContact N-O 3Å; S331-V347 WeakPolarHBondContact OG-CG1 3.38Å; S331-V347 PolarHBondContact OG-O 3.12Å; A332-V347 PolarHBondContact N-O 2.82Å; A332-V347 PolarHBondContact O-N 2.8Å; V347-Y359 CarbonylContact C-O 3.51Å; V347-Y359 VanDerWaalsContact CA-O 3.32Å; V347-Y359 WeakPolarHBondContact CA-O 3.18Å; V347-I376 HydrophobicContact CG1-CD1 3.98Å; V347-I376 HydrophobicContact CG2-CD1 4.32Å; V347-F382 HydrophobicContact CG1-CB 4.11Å; V347-F382 WeakPolarHBondContact CG1-O 3.46Å; V347-I385 HydrophobicContact CG2-CB 3.84Å; V347-I385 HydrophobicContact CG2-CD1 3.98Å; V347-I385 HydrophobicContact CG2-CG1 4.48Å; V347-I385 HydrophobicContact CG2-CG2 4.08Å
348	K	98.7	Very high	96.3	Very high	10 Å²	10	33.6 Å²	33.6	4%	0.043	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	135.5	164.1	-64	177	-175.2	162.8	0	108.9	R328 G329 F330 S358 Y359 D373	R328-K348 HydrophobicContact CB-CB 4.29Å; R328-K348 HydrophobicContact CB-CD 4.15Å; G329-K348 CarbonylContact O-C 3.57Å; G329-K348 WeakPolarHBondContact O-CA 3.44Å; G329-K348 WeakPolarHBondContact O-CB 3.25Å; F330-K348 HydrophobicContact CD1-CD 4.35Å; F330-K348 HydrophobicContact CD1-CG 3.63Å; F330-K348 HydrophobicContact CE1-CD 4.21Å; F330-K348 HydrophobicContact CE1-CG 3.95Å; F330-K348 HydrophobicContact CG-CG 4.24Å; K348-S358 CarbonylContact O-C 3.49Å; K348-S358 VanDerWaalsContact O-CA 3.3Å; K348-S358 WeakPolarHBondContact O-CA 3.39Å; K348-Y359 PolarHBondContact N-O 2.87Å; K348-Y359 PolarHBondContact O-N 3.23Å; K348-D373 IonicContact NZ-OD1 3.79Å; K348-D373 PolarHBondContact NZ-OD1 3.07Å; K348-D373 IonicContact NZ-OD2 3.54Å
349	S	97.8	Very high	96.7	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	151.8	170	54.2	0	0	0	0	110.7	R286 G329 N357	R286-S349 PolarHBondContact NH1-OG 3.22Å; R286-S349 PolarHBondContact NH2-OG 3.21Å; G329-S349 PolarHBondContact N-O 3.43Å; G329-S349 PolarHBondContact O-N 3.26Å; S349-N357 CarbonylContact C-O 3.6Å; S349-N357 WeakPolarHBondContact CA-O 3.02Å
350	E	96.9	Very high	96.8	Very high	30 Å²	30	28.6 Å²	28.6	14%	0.14	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	127.5	-178.7	177.8	173.2	-107	0	0	107.8	T327 R328 I352 V356 N357 Y359	T327-E350 VanDerWaalsContact CB-OE1 3.25Å; T327-E350 WeakPolarHBondContact CB-OE1 3.45Å; T327-E350 PolarHBondContact OG1-OE1 3.1Å; R328-E350 HydrophobicContact CG-CB 4.07Å; R328-E350 HydrophobicContact CG-CG 4.39Å; R328-E350 WeakPolarHBondContact CG-OE1 3.3Å; R328-E350 IonicContact NE-OE1 2.73Å; E350-I352 HydrophobicContact CG-CG1 3.96Å; E350-V356 CarbonylContact O-C 3.26Å; E350-V356 VanDerWaalsContact O-CA 3.29Å; E350-V356 WeakPolarHBondContact O-CA 3.34Å; E350-N357 PolarHBondContact N-O 3.06Å; E350-N357 PolarHBondContact O-N 2.92Å; E350-Y359 HydrophobicContact CB-CE2 4.16Å; E350-Y359 PolarHBondContact OE2-OH 2.78Å
351	E	94.7	Very high	97	Very high	41 Å²	41	26.7 Å²	26.7	19%	0.192	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	109.3	179.5	-60.9	176.7	-112.6	0	0	106.7	R286 E299 I355 V356 K381	R286-E351 IonicContact CZ-OE1 2.88Å; R286-E351 IonicContact NH1-OE1 3.45Å; R286-E351 IonicContact NH2-OE1 2.87Å; R286-E351 PolarHBondContact NH2-OE1 3.02Å; E299-E351 WeakPolarHBondContact CG-O 3.08Å; E351-I355 WeakPolarHBondContact CA-O 3.37Å; E351-V356 HydrophobicContact CB-CG1 4.49Å; E351-V356 HydrophobicContact CG-CB 4.49Å; E351-V356 HydrophobicContact CG-CG1 3.91Å; E351-K381 VanDerWaalsContact CD-NZ 3.27Å; E351-K381 HydrophobicContact CG-CD 4.25Å; E351-K381 WeakPolarHBondContact OE1-CD 3.2Å; E351-K381 WeakPolarHBondContact OE1-CE 3.42Å; E351-K381 IonicContact OE1-NZ 3.69Å; E351-K381 PolarHBondContact OE1-NZ 2.81Å; E351-K381 IonicContact OE2-NZ 3Å; E351-K381 PolarHBondContact OE2-NZ 2.73Å; E351-K381 VanDerWaalsContact OE2-NZ 3.1Å
352	I	94.9	Very high	97	Very high	52 Å²	52	25.4 Å²	25.4	27%	0.267	17%	0.167	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	114.1	-178	-60.1	-69.8	0	0	0	108.8	E299 T327 E350 G354 I355	E299-I352 HydrophobicContact CB-CD1 3.92Å; T327-I352 HydrophobicContact CG2-CD1 3.36Å; T327-I352 HydrophobicContact CG2-CG1 4.01Å; E350-I352 HydrophobicContact CG-CG1 3.96Å; I352-G354 PolarHBondContact O-N 2.92Å; I352-G354 VanDerWaalsContact O-N 3.15Å; I352-I355 PolarHBondContact N-O 2.87Å; I352-I355 PolarHBondContact O-N 3.07Å
353	G	91.4	Very high	97.1	Very high	68 Å²	68	23.1 Å²	23.1	70%	0.701	15%	0.151	S	C	*	.	T	Hydrogen-bonded Turn	trans	54.6	34.7	178.9	0	0	0	0	0	113.4	E299 I355	E299-G353 PolarHBondContact OE1-N 2.85Å; E299-G353 PolarHBondContact OE2-N 2.94Å; E299-G353 VanDerWaalsContact OE2-N 3.11Å; G353-I355 VanDerWaalsContact C-N 3.34Å; G353-I355 PolarHBondContact O-N 2.98Å
354	G	89.6	Confident	97.1	Very high	69 Å²	69	22.8 Å²	22.8	71%	0.711	15%	0.15	S	C	*	.	T	Hydrogen-bonded Turn	trans	81.8	-0.2	-178.4	0	0	0	0	0	115.8	I352	I352-G354 PolarHBondContact O-N 2.92Å; I352-G354 VanDerWaalsContact O-N 3.15Å
355	I	94.1	Very high	97.1	Very high	117 Å²	117	24 Å²	24	60%	0.6	16%	0.156	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-87.5	125.6	170.7	-59	174.4	0	0	0	108.3	E351 I352 G353	E351-I355 WeakPolarHBondContact CA-O 3.37Å; I352-I355 PolarHBondContact N-O 2.87Å; I352-I355 PolarHBondContact O-N 3.07Å; G353-I355 VanDerWaalsContact C-N 3.34Å; G353-I355 PolarHBondContact O-N 2.98Å
356	V	96.4	Very high	97	Very high	41 Å²	41	28.8 Å²	28.8	25%	0.248	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	136.6	-178.3	-51	0	0	0	0	112.1	E350 E351 N379 K381	E350-V356 CarbonylContact O-C 3.26Å; E350-V356 VanDerWaalsContact O-CA 3.29Å; E350-V356 WeakPolarHBondContact O-CA 3.34Å; E351-V356 HydrophobicContact CB-CG1 4.49Å; E351-V356 HydrophobicContact CG-CB 4.49Å; E351-V356 HydrophobicContact CG-CG1 3.91Å; V356-N379 VanDerWaalsContact CG2-O 3.28Å; V356-N379 WeakPolarHBondContact CG2-O 3.44Å; V356-K381 HydrophobicContact CB-CB 4.18Å; V356-K381 HydrophobicContact CG2-CB 4.31Å
357	N	97.7	Very high	97	Very high	27 Å²	27	29.2 Å²	29.2	14%	0.144	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	153.4	171.3	-69.8	-72.8	0	0	0	110.1	S349 E350 Y359 N379	S349-N357 CarbonylContact C-O 3.6Å; S349-N357 WeakPolarHBondContact CA-O 3.02Å; E350-N357 PolarHBondContact N-O 3.06Å; E350-N357 PolarHBondContact O-N 2.92Å; N357-Y359 HydrophobicContact CB-CE2 3.93Å; N357-N379 PolarHBondContact OD1-OD1 2.88Å
358	S	98.6	Very high	96.9	Very high	0 Å²	0	35 Å²	35	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	150.3	173	-54.1	0	0	0	0	111.4	K348 I376 F380 K381 F382	K348-S358 CarbonylContact O-C 3.49Å; K348-S358 VanDerWaalsContact O-CA 3.3Å; K348-S358 WeakPolarHBondContact O-CA 3.39Å; S358-I376 PolarHBondContact O-N 2.65Å; S358-F380 PolarHBondContact OG-O 2.84Å; S358-K381 WeakPolarHBondContact OG-CA 3.4Å; S358-F382 PolarHBondContact OG-N 2.92Å
359	Y	98.7	Very high	96.9	Very high	23 Å²	23	37.2 Å²	37.2	9%	0.09	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	141	-175.4	-55.2	-88.5	0	0	0	109.7	R328 V347 K348 E350 N357 D373 S374 I375	R328-Y359 HydrophobicContact CG-CD2 4.23Å; R328-Y359 HydrophobicContact CG-CE2 4.06Å; R328-Y359 PolarHBondContact NH2-OH 3.44Å; V347-Y359 CarbonylContact C-O 3.51Å; V347-Y359 VanDerWaalsContact CA-O 3.32Å; V347-Y359 WeakPolarHBondContact CA-O 3.18Å; K348-Y359 PolarHBondContact N-O 2.87Å; K348-Y359 PolarHBondContact O-N 3.23Å; E350-Y359 HydrophobicContact CB-CE2 4.16Å; E350-Y359 PolarHBondContact OE2-OH 2.78Å; N357-Y359 HydrophobicContact CB-CE2 3.93Å; Y359-D373 HydrophobicContact CD1-CB 4.14Å; Y359-D373 HydrophobicContact CG-CB 4.16Å; Y359-S374 CarbonylContact C-O 3.58Å; Y359-S374 VanDerWaalsContact CA-O 3.23Å; Y359-S374 WeakPolarHBondContact CA-O 3.28Å; Y359-I375 HydrophobicContact CD1-CB 4.26Å; Y359-I375 HydrophobicContact CE1-CB 4.25Å; Y359-I375 HydrophobicContact CE1-CG1 4.32Å
360	L	98.8	Very high	96.9	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	135.9	168.4	-171	134.8	0	0	0	109.4	I91 V130 W132 V345 A346 V362 L371 S374 I376 I385	I91-L360 HydrophobicContact CD1-CD1 3.55Å; V130-L360 HydrophobicContact CB-CD2 4.13Å; V130-L360 HydrophobicContact CG1-CD2 4.13Å; V130-L360 HydrophobicContact CG2-CD2 4.3Å; W132-L360 HydrophobicContact CH2-CD1 3.81Å; W132-L360 HydrophobicContact CZ2-CB 4.06Å; W132-L360 HydrophobicContact CZ2-CD1 3.75Å; W132-L360 HydrophobicContact CZ2-CG 4.49Å; V345-L360 HydrophobicContact CG2-CD1 3.78Å; V345-L360 HydrophobicContact CG2-CD2 3.89Å; V345-L360 HydrophobicContact CG2-CG 3.85Å; A346-L360 WeakPolarHBondContact O-CA 3.28Å; L360-V362 HydrophobicContact CD2-CG2 4.25Å; L360-L371 HydrophobicContact CD2-CD2 3.8Å; L360-S374 PolarHBondContact N-O 2.96Å; L360-S374 PolarHBondContact O-N 2.76Å; L360-I376 HydrophobicContact CB-CD1 4.34Å; L360-I376 HydrophobicContact CB-CG1 4.26Å; L360-I385 HydrophobicContact CD1-CD1 3.75Å
361	T	98.8	Very high	97	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134	152.3	174.5	-176.7	0	0	0	0	110.1	F330 A346 F363 L371	F330-T361 HydrophobicContact CE1-CG2 4.17Å; A346-T361 HydrophobicContact CB-CG2 4.11Å; A346-T361 PolarHBondContact N-O 3.5Å; A346-T361 PolarHBondContact O-N 2.81Å; T361-F363 HydrophobicContact CG2-CD1 4.05Å; T361-F363 HydrophobicContact CG2-CE1 4.07Å; T361-L371 WeakPolarHBondContact CA-O 3.15Å; T361-L371 PolarHBondContact OG1-O 3.48Å
362	V	98.9	Very high	97.2	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	132.5	174.5	-177.8	0	0	0	0	108.9	L119 L121 A128 I336 I344 V345 L360 L370 L371	L119-V362 HydrophobicContact CD1-CG2 3.75Å; L121-V362 HydrophobicContact CD2-CG1 4.4Å; A128-V362 HydrophobicContact CB-CB 4.01Å; A128-V362 HydrophobicContact CB-CG1 4.09Å; A128-V362 HydrophobicContact CB-CG2 4Å; I336-V362 HydrophobicContact CD1-CG1 3.65Å; I344-V362 WeakPolarHBondContact O-CA 3.42Å; V345-V362 HydrophobicContact CB-CG2 4.3Å; V345-V362 HydrophobicContact CG2-CG2 4.14Å; L360-V362 HydrophobicContact CD2-CG2 4.25Å; V362-L370 HydrophobicContact CB-CB 4.29Å; V362-L370 HydrophobicContact CG1-CB 4.03Å; V362-L370 HydrophobicContact CG1-CD2 4.26Å; V362-L370 PolarHBondContact O-N 2.93Å; V362-L371 HydrophobicContact CB-CB 3.84Å; V362-L371 HydrophobicContact CG2-CB 4.05Å; V362-L371 HydrophobicContact CG2-CD2 4.15Å; V362-L371 PolarHBondContact N-O 2.82Å; V362-L371 VanDerWaalsContact N-O 3.09Å; V362-L371 PolarHBondContact O-N 2.84Å
363	F	98.8	Very high	97.3	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.8	159.6	-178.7	58.6	-89	0	0	0	111.8	L284 V321 F330 I344 A346 T361 R368 I369	L284-F363 HydrophobicContact CD1-CE1 4.48Å; L284-F363 HydrophobicContact CD1-CZ 3.7Å; L284-F363 HydrophobicContact CD2-CE2 4.29Å; L284-F363 HydrophobicContact CD2-CZ 3.86Å; L284-F363 HydrophobicContact CG-CZ 4.46Å; V321-F363 HydrophobicContact CB-CD2 4.31Å; V321-F363 HydrophobicContact CB-CE2 4.36Å; V321-F363 HydrophobicContact CG1-CB 3.89Å; V321-F363 HydrophobicContact CG1-CD1 3.67Å; V321-F363 HydrophobicContact CG1-CD2 3.43Å; V321-F363 VanDerWaalsContact CG1-CD2 3.43Å; V321-F363 HydrophobicContact CG1-CE1 3.98Å; V321-F363 HydrophobicContact CG1-CE2 3.77Å; V321-F363 HydrophobicContact CG1-CG 3.38Å; V321-F363 HydrophobicContact CG1-CZ 4.03Å; V321-F363 HydrophobicContact CG2-CD2 3.85Å; V321-F363 HydrophobicContact CG2-CE2 3.63Å; V321-F363 HydrophobicContact CG2-CZ 4.24Å; F330-F363 AromaticContact CE1-CE1 3.78Å; F330-F363 HydrophobicContact CE1-CE1 3.78Å; F330-F363 HydrophobicContact CE1-CZ 4.11Å; F330-F363 HydrophobicContact CZ-CE1 4.21Å; F330-F363 HydrophobicContact CZ-CZ 4.28Å; I344-F363 HydrophobicContact CB-CD2 4.42Å; I344-F363 HydrophobicContact CB-CE1 4.46Å; I344-F363 HydrophobicContact CB-CE2 4.01Å; I344-F363 HydrophobicContact CB-CZ 4.04Å; I344-F363 HydrophobicContact CD1-CE2 3.99Å; I344-F363 HydrophobicContact CD1-CZ 4.41Å; I344-F363 HydrophobicContact CG2-CE1 4Å; I344-F363 HydrophobicContact CG2-CE2 4.14Å; I344-F363 HydrophobicContact CG2-CZ 3.66Å; I344-F363 PolarHBondContact N-O 2.87Å; I344-F363 PolarHBondContact O-N 3.01Å; A346-F363 HydrophobicContact CB-CE1 3.78Å; A346-F363 HydrophobicContact CB-CZ 4.36Å; T361-F363 HydrophobicContact CG2-CD1 4.05Å; T361-F363 HydrophobicContact CG2-CE1 4.07Å; F363-R368 CarbonylContact C-O 3.59Å; F363-R368 WeakPolarHBondContact CA-O 3.43Å; F363-R368 VanDerWaalsContact CB-O 3.29Å; F363-R368 WeakPolarHBondContact CB-O 3.28Å; F363-I369 HydrophobicContact CB-CD1 3.81Å
364	G	98.5	Very high	97.7	Very high	1 Å²	1	38 Å²	38	1%	0.01	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	156.1	171.6	0	0	0	0	0	112.1	S342 D366 G367 R368	S342-G364 CarbonylContact O-C 3.52Å; S342-G364 VanDerWaalsContact O-CA 3.26Å; S342-G364 WeakPolarHBondContact O-CA 3.5Å; G364-D366 VanDerWaalsContact C-OD1 3.29Å; G364-D366 VanDerWaalsContact CA-OD1 3.3Å; G364-D366 WeakPolarHBondContact CA-OD1 3.41Å; G364-D366 PolarHBondContact O-N 3.48Å; G364-G367 WeakPolarHBondContact O-CA 3.38Å; G364-G367 PolarHBondContact O-N 2.72Å; G364-R368 PolarHBondContact N-O 3.31Å
365	I	98.4	Very high	98.1	Very high	25 Å²	25	39.1 Å²	39.1	13%	0.128	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-10.4	173.8	64.4	171	0	0	0	113.4	F282 L306 D341 S342 I344 G367	F282-I365 HydrophobicContact CD1-CG2 4.5Å; F282-I365 HydrophobicContact CE1-CB 4.29Å; F282-I365 HydrophobicContact CE1-CG2 3.71Å; L306-I365 HydrophobicContact CD2-CB 4.25Å; L306-I365 HydrophobicContact CD2-CG2 4.49Å; D341-I365 WeakPolarHBondContact O-CG2 3.45Å; S342-I365 PolarHBondContact O-N 2.81Å; I344-I365 HydrophobicContact CD1-CG2 3.94Å; I344-I365 HydrophobicContact CG1-CG2 4.32Å; I365-G367 VanDerWaalsContact C-N 3.31Å
366	D	97.7	Very high	98.3	Very high	100 Å²	100	33.5 Å²	33.5	54%	0.535	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.4	-5.2	170.2	64.7	-11.7	0	0	0	113.4	G364 R368	G364-D366 VanDerWaalsContact C-OD1 3.29Å; G364-D366 VanDerWaalsContact CA-OD1 3.3Å; G364-D366 WeakPolarHBondContact CA-OD1 3.41Å; G364-D366 PolarHBondContact O-N 3.48Å; D366-R368 WeakPolarHBondContact OD1-CB 3.45Å; D366-R368 PolarHBondContact OD1-N 3.2Å; D366-R368 VanDerWaalsContact OD1-N 3.09Å; D366-R368 IonicContact OD2-NE 2.73Å
367	G	98.1	Very high	98.3	Very high	9 Å²	9	34 Å²	34	9%	0.093	18%	0.182	C	C	.	.	S	Bend	trans	88.8	-0.2	-179.8	0	0	0	0	0	114.5	Y320 G322 G364 I365 I369	Y320-G367 WeakPolarHBondContact O-CA 3.22Å; G322-G367 PolarHBondContact N-O 3.42Å; G364-G367 WeakPolarHBondContact O-CA 3.38Å; G364-G367 PolarHBondContact O-N 2.72Å; I365-G367 VanDerWaalsContact C-N 3.31Å; G367-I369 PolarHBondContact O-N 3.34Å
368	R	97.3	Very high	98.3	Very high	121 Å²	121	34.8 Å²	34.8	46%	0.457	20%	0.197	S	C	.	.			trans	-75.4	125.7	-179.9	-178.5	172.2	55.1	94.3	2.8	110.6	F363 G364 D366 L370	F363-R368 CarbonylContact C-O 3.59Å; F363-R368 WeakPolarHBondContact CA-O 3.43Å; F363-R368 VanDerWaalsContact CB-O 3.29Å; F363-R368 WeakPolarHBondContact CB-O 3.28Å; G364-R368 PolarHBondContact N-O 3.31Å; D366-R368 WeakPolarHBondContact OD1-CB 3.45Å; D366-R368 PolarHBondContact OD1-N 3.2Å; D366-R368 VanDerWaalsContact OD1-N 3.09Å; D366-R368 IonicContact OD2-NE 2.73Å; R368-L370 WeakPolarHBondContact O-CD1 3.41Å
369	I	98.5	Very high	98.1	Very high	57 Å²	57	39.6 Å²	39.6	29%	0.292	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	128.7	178	-56.3	-55.9	0	0	0	110.4	V321 F363 G367 L371 P372	V321-I369 HydrophobicContact CG1-CD1 3.7Å; F363-I369 HydrophobicContact CB-CD1 3.81Å; G367-I369 PolarHBondContact O-N 3.34Å; I369-L371 VanDerWaalsContact CG2-C 3.41Å; I369-L371 WeakPolarHBondContact CG2-O 3.45Å; I369-P372 HydrophobicContact CG2-CB 4.4Å; I369-P372 HydrophobicContact CG2-CG 4.05Å
370	L	98.5	Very high	98.1	Very high	11 Å²	11	40.4 Å²	40.4	6%	0.058	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	-32.4	171.8	-79.7	67.2	0	0	0	111.4	M125 A128 L343 V362 R368	M125-L370 VanDerWaalsContact O-CD2 3.3Å; M125-L370 WeakPolarHBondContact O-CD2 3.38Å; A128-L370 HydrophobicContact CB-CB 4.42Å; A128-L370 PolarHBondContact N-O 2.79Å; L343-L370 HydrophobicContact CD1-CD2 3.68Å; L343-L370 HydrophobicContact CD2-CD1 4.12Å; L343-L370 HydrophobicContact CD2-CD2 3.75Å; L343-L370 HydrophobicContact CG-CD2 4.35Å; V362-L370 HydrophobicContact CB-CB 4.29Å; V362-L370 HydrophobicContact CG1-CB 4.03Å; V362-L370 HydrophobicContact CG1-CD2 4.26Å; V362-L370 PolarHBondContact O-N 2.93Å; R368-L370 WeakPolarHBondContact O-CD1 3.41Å
371	L	98.6	Very high	98	Very high	22 Å²	22	41.1 Å²	41.1	12%	0.115	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	110.9	171.9	173.7	58.8	0	0	0	108.4	A128 V130 L360 T361 V362 I369	A128-L371 HydrophobicContact CB-CB 4.04Å; V130-L371 HydrophobicContact CB-CD2 4.33Å; V130-L371 HydrophobicContact CG1-CD2 4Å; L360-L371 HydrophobicContact CD2-CD2 3.8Å; T361-L371 WeakPolarHBondContact CA-O 3.15Å; T361-L371 PolarHBondContact OG1-O 3.48Å; V362-L371 HydrophobicContact CB-CB 3.84Å; V362-L371 HydrophobicContact CG2-CB 4.05Å; V362-L371 HydrophobicContact CG2-CD2 4.15Å; V362-L371 PolarHBondContact N-O 2.82Å; V362-L371 VanDerWaalsContact N-O 3.09Å; V362-L371 PolarHBondContact O-N 2.84Å; I369-L371 VanDerWaalsContact CG2-C 3.41Å; I369-L371 WeakPolarHBondContact CG2-O 3.45Å
372	P	98.2	Very high	98	Very high	91 Å²	91	41.1 Å²	41.1	59%	0.591	23%	0.23	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-57.3	162.6	169	-22.2	33.7	0	0	0	111.5	I369 S374	I369-P372 HydrophobicContact CG2-CB 4.4Å; I369-P372 HydrophobicContact CG2-CG 4.05Å; P372-S374 PolarHBondContact O-N 2.9Å
373	D	98.4	Very high	98	Very high	44 Å²	44	41.3 Å²	41.3	24%	0.235	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-46.1	107.3	178.5	-65.6	-1	0	0	0	111.8	R328 K348 Y359	R328-D373 WeakPolarHBondContact CD-OD2 3.31Å; R328-D373 IonicContact CZ-OD2 3.91Å; R328-D373 IonicContact NE-OD2 3.54Å; R328-D373 IonicContact NH1-OD2 3.53Å; R328-D373 PolarHBondContact NH1-OD2 3.37Å; K348-D373 IonicContact NZ-OD1 3.79Å; K348-D373 PolarHBondContact NZ-OD1 3.07Å; K348-D373 IonicContact NZ-OD2 3.54Å; Y359-D373 HydrophobicContact CD1-CB 4.14Å; Y359-D373 HydrophobicContact CG-CB 4.16Å
374	S	98.3	Very high	98	Very high	39 Å²	39	41.3 Å²	41.3	27%	0.273	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	127.7	177.4	-174.9	0	0	0	0	108.9	Y359 L360 P372	Y359-S374 CarbonylContact C-O 3.58Å; Y359-S374 VanDerWaalsContact CA-O 3.23Å; Y359-S374 WeakPolarHBondContact CA-O 3.28Å; L360-S374 PolarHBondContact N-O 2.96Å; L360-S374 PolarHBondContact O-N 2.76Å; P372-S374 PolarHBondContact O-N 2.9Å
375	I	98.3	Very high	98	Very high	93 Å²	93	41.2 Å²	41.2	48%	0.477	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.1	137.6	-174.6	-165.9	165.4	0	0	0	111.7	W132 Y359	W132-I375 PolarHBondContact NE1-O 2.86Å; Y359-I375 HydrophobicContact CD1-CB 4.26Å; Y359-I375 HydrophobicContact CE1-CB 4.25Å; Y359-I375 HydrophobicContact CE1-CG1 4.32Å
376	I	98.6	Very high	98	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	23%	0.227	C	C	.	.	P	Polyproline II helix	trans	-88.6	128.9	168	-50.4	-174.8	0	0	0	107.3	V93 W132 V347 S358 L360 F382	V93-I376 HydrophobicContact CG1-CD1 4.29Å; V93-I376 HydrophobicContact CG2-CD1 4.45Å; V93-I376 HydrophobicContact CG2-CG2 4.08Å; W132-I376 HydrophobicContact CD2-CG2 4.39Å; W132-I376 HydrophobicContact CH2-CD1 4.25Å; W132-I376 HydrophobicContact CH2-CG1 4.36Å; W132-I376 HydrophobicContact CH2-CG2 4.17Å; W132-I376 HydrophobicContact CZ2-CB 4.23Å; W132-I376 HydrophobicContact CZ2-CD1 4.01Å; W132-I376 HydrophobicContact CZ2-CG1 3.67Å; W132-I376 HydrophobicContact CZ2-CG2 3.9Å; V347-I376 HydrophobicContact CG1-CD1 3.98Å; V347-I376 HydrophobicContact CG2-CD1 4.32Å; S358-I376 PolarHBondContact O-N 2.65Å; L360-I376 HydrophobicContact CB-CD1 4.34Å; L360-I376 HydrophobicContact CB-CG1 4.26Å; I376-F382 HydrophobicContact CB-CD2 4.1Å; I376-F382 HydrophobicContact CB-CE2 4.25Å; I376-F382 HydrophobicContact CD1-CB 4.39Å; I376-F382 HydrophobicContact CD1-CD2 4.29Å; I376-F382 HydrophobicContact CG2-CD2 3.61Å; I376-F382 HydrophobicContact CG2-CE2 3.44Å; I376-F382 VanDerWaalsContact CG2-CE2 3.44Å; I376-F382 HydrophobicContact CG2-CG 4.47Å; I376-F382 HydrophobicContact CG2-CZ 4.24Å
377	P	97.7	Very high	98	Very high	51 Å²	51	37.1 Å²	37.1	33%	0.331	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.9	152.8	-173.9	26.1	-35.7	0	0	0	112.9	W132	W132-P377 HydrophobicContact CB-CG 3.79Å; W132-P377 VanDerWaalsContact CG-CD 3.45Å; W132-P377 HydrophobicContact CG-CG 3.87Å
378	G	96	Very high	97.7	Very high	43 Å²	43	41.5 Å²	41.5	44%	0.443	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	102.5	-5.5	169.5	0	0	0	0	0	116.3	F380	G378-F380 PolarHBondContact O-N 3.14Å
379	N	96.1	Very high	97.7	Very high	101 Å²	101	37.5 Å²	37.5	54%	0.54	22%	0.216	S	C	.	.	S	Bend	trans	52.6	42.8	-176.5	-55.2	-13.8	0	0	0	112.1	V356 N357	V356-N379 VanDerWaalsContact CG2-O 3.28Å; V356-N379 WeakPolarHBondContact CG2-O 3.44Å; N357-N379 PolarHBondContact OD1-OD1 2.88Å
380	F	97.4	Very high	97.7	Very high	41 Å²	41	36.5 Å²	36.5	18%	0.18	21%	0.212	C	C	.	.			trans	-101.2	155.9	173.5	-56.9	-61.9	0	0	0	110.3	L97 I113 Y136 S358 G378 F382	L97-F380 HydrophobicContact CD2-CB 4.15Å; L97-F380 HydrophobicContact CD2-CD1 3.71Å; L97-F380 HydrophobicContact CD2-CG 4.27Å; I113-F380 HydrophobicContact CB-CD2 4.44Å; I113-F380 HydrophobicContact CD1-CZ 4.32Å; I113-F380 HydrophobicContact CG1-CD1 4.17Å; I113-F380 HydrophobicContact CG1-CD2 4.11Å; I113-F380 HydrophobicContact CG1-CE1 4.14Å; I113-F380 HydrophobicContact CG1-CE2 4.07Å; I113-F380 HydrophobicContact CG1-CG 4.15Å; I113-F380 HydrophobicContact CG1-CZ 4.09Å; I113-F380 HydrophobicContact CG2-CD2 4.08Å; I113-F380 HydrophobicContact CG2-CE2 4.11Å; Y136-F380 HydrophobicContact CD1-CE2 4.42Å; Y136-F380 AromaticContact CE1-CE2 3.95Å; Y136-F380 HydrophobicContact CE1-CE2 3.95Å; Y136-F380 HydrophobicContact CE1-CZ 4.37Å; S358-F380 PolarHBondContact OG-O 2.84Å; G378-F380 PolarHBondContact O-N 3.14Å; F380-F382 HydrophobicContact CB-CD2 4.13Å; F380-F382 HydrophobicContact CB-CE2 3.69Å; F380-F382 HydrophobicContact CB-CZ 3.99Å; F380-F382 HydrophobicContact CD2-CE2 4.14Å; F380-F382 AromaticContact CD2-CZ 3.98Å; F380-F382 HydrophobicContact CD2-CZ 3.98Å; F380-F382 HydrophobicContact CG-CE2 4.43Å; F380-F382 HydrophobicContact CG-CZ 4.44Å
381	K	97.8	Very high	97.6	Very high	15 Å²	15	37.9 Å²	37.9	7%	0.065	22%	0.221	C	C	.	.			trans	-86.3	109	168.6	170	-178	174.7	175.7	0	108.4	S95 D96 D98 E351 V356 S358 E383	S95-K381 CarbonylContact C-O 3.6Å; S95-K381 WeakPolarHBondContact CA-O 3.48Å; S95-K381 WeakPolarHBondContact CB-O 3.26Å; D96-K381 PolarHBondContact N-O 3.24Å; D96-K381 VanDerWaalsContact O-CB 3.22Å; D96-K381 WeakPolarHBondContact O-CB 3.43Å; D96-K381 WeakPolarHBondContact O-CD 3.41Å; D96-K381 WeakPolarHBondContact O-CG 3.49Å; D96-K381 VanDerWaalsContact O-O 3.04Å; D98-K381 IonicContact OD1-NZ 3.75Å; D98-K381 IonicContact OD2-NZ 3.96Å; D98-K381 PolarHBondContact OD2-NZ 2.87Å; E351-K381 VanDerWaalsContact CD-NZ 3.27Å; E351-K381 HydrophobicContact CG-CD 4.25Å; E351-K381 WeakPolarHBondContact OE1-CD 3.2Å; E351-K381 WeakPolarHBondContact OE1-CE 3.42Å; E351-K381 IonicContact OE1-NZ 3.69Å; E351-K381 PolarHBondContact OE1-NZ 2.81Å; E351-K381 IonicContact OE2-NZ 3Å; E351-K381 PolarHBondContact OE2-NZ 2.73Å; E351-K381 VanDerWaalsContact OE2-NZ 3.1Å; V356-K381 HydrophobicContact CB-CB 4.18Å; V356-K381 HydrophobicContact CG2-CB 4.31Å; S358-K381 WeakPolarHBondContact OG-CA 3.4Å; K381-E383 WeakPolarHBondContact CE-OE1 3.39Å; K381-E383 HydrophobicContact CG-CG 4.01Å; K381-E383 IonicContact NZ-OE1 3.77Å
382	F	98.6	Very high	97.6	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	130.3	177.9	-72	-76.3	0	0	0	109.1	V93 I94 I113 Q115 S331 V347 S358 I376 F380	V93-F382 HydrophobicContact CB-CB 4.26Å; V93-F382 HydrophobicContact CB-CD1 3.78Å; V93-F382 HydrophobicContact CB-CE1 4.38Å; V93-F382 HydrophobicContact CB-CG 4.13Å; V93-F382 HydrophobicContact CG2-CB 4.47Å; V93-F382 HydrophobicContact CG2-CD1 3.48Å; V93-F382 VanDerWaalsContact CG2-CD1 3.48Å; V93-F382 HydrophobicContact CG2-CD2 4.32Å; V93-F382 HydrophobicContact CG2-CE1 3.66Å; V93-F382 HydrophobicContact CG2-CE2 4.42Å; V93-F382 HydrophobicContact CG2-CG 3.85Å; V93-F382 HydrophobicContact CG2-CZ 4.13Å; I94-F382 VanDerWaalsContact C-CD1 3.47Å; I94-F382 WeakPolarHBondContact O-CA 3.38Å; I94-F382 WeakPolarHBondContact O-CD1 3.48Å; I113-F382 HydrophobicContact CB-CE1 4.25Å; I113-F382 HydrophobicContact CB-CZ 4.46Å; I113-F382 HydrophobicContact CG2-CE1 4.11Å; I113-F382 HydrophobicContact CG2-CZ 4.01Å; Q115-F382 HydrophobicContact CB-CE1 3.94Å; Q115-F382 HydrophobicContact CB-CZ 3.77Å; Q115-F382 HydrophobicContact CG-CZ 4.49Å; S331-F382 PolarHBondContact OG-O 3.14Å; V347-F382 HydrophobicContact CG1-CB 4.11Å; V347-F382 WeakPolarHBondContact CG1-O 3.46Å; S358-F382 PolarHBondContact OG-N 2.92Å; I376-F382 HydrophobicContact CB-CD2 4.1Å; I376-F382 HydrophobicContact CB-CE2 4.25Å; I376-F382 HydrophobicContact CD1-CB 4.39Å; I376-F382 HydrophobicContact CD1-CD2 4.29Å; I376-F382 HydrophobicContact CG2-CD2 3.61Å; I376-F382 HydrophobicContact CG2-CE2 3.44Å; I376-F382 VanDerWaalsContact CG2-CE2 3.44Å; I376-F382 HydrophobicContact CG2-CG 4.47Å; I376-F382 HydrophobicContact CG2-CZ 4.24Å; F380-F382 HydrophobicContact CB-CD2 4.13Å; F380-F382 HydrophobicContact CB-CE2 3.69Å; F380-F382 HydrophobicContact CB-CZ 3.99Å; F380-F382 HydrophobicContact CD2-CE2 4.14Å; F380-F382 AromaticContact CD2-CZ 3.98Å; F380-F382 HydrophobicContact CD2-CZ 3.98Å; F380-F382 HydrophobicContact CG-CE2 4.43Å; F380-F382 HydrophobicContact CG-CZ 4.44Å
383	E	98.4	Very high	97.5	Very high	3 Å²	3	35.6 Å²	35.6	1%	0.014	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	-16.4	-174.1	-59.9	-154.2	144.8	0	0	113.6	I94 D96 S153 R286 S331 A332 K381	I94-E383 PolarHBondContact O-N 3.49Å; D96-E383 HydrophobicContact CB-CB 4.39Å; D96-E383 HydrophobicContact CB-CG 3.97Å; D96-E383 WeakPolarHBondContact CB-OE2 3.12Å; S153-E383 CarbonylContact O-C 3.44Å; S153-E383 WeakPolarHBondContact O-CB 3.33Å; R286-E383 IonicContact CZ-OE1 3.39Å; R286-E383 IonicContact NH1-OE1 2.84Å; R286-E383 PolarHBondContact NH1-OE1 3.17Å; S331-E383 CarbonylContact C-O 3.57Å; A332-E383 WeakPolarHBondContact CB-O 3.2Å; K381-E383 WeakPolarHBondContact CE-OE1 3.39Å; K381-E383 HydrophobicContact CG-CG 4.01Å; K381-E383 IonicContact NZ-OE1 3.77Å
384	G	98.6	Very high	97.5	Very high	0 Å²	0	35 Å²	35	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	150.8	169.7	0	0	0	0	0	113.8	V93 I94	V93-G384 WeakPolarHBondContact CA-O 3.26Å; V93-G384 WeakPolarHBondContact CB-O 3.48Å; I94-G384 PolarHBondContact N-O 2.82Å; I94-G384 VanDerWaalsContact N-O 3.07Å; I94-G384 PolarHBondContact O-N 3Å
385	I	98.8	Very high	97.4	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	141.9	170.2	-176.3	162.1	0	0	0	111.6	V92 V93 A332 Q334 V345 V347 L360	V92-I385 VanDerWaalsContact O-CA 3.28Å; V92-I385 WeakPolarHBondContact O-CA 3.47Å; V92-I385 WeakPolarHBondContact O-CG1 3.43Å; V93-I385 HydrophobicContact CG1-CB 4.09Å; V93-I385 HydrophobicContact CG1-CD1 4.09Å; V93-I385 HydrophobicContact CG1-CG1 4.05Å; A332-I385 HydrophobicContact CB-CB 4.45Å; A332-I385 HydrophobicContact CB-CG2 3.61Å; Q334-I385 HydrophobicContact CG-CG2 4.21Å; Q334-I385 VanDerWaalsContact CG-O 3.26Å; Q334-I385 WeakPolarHBondContact CG-O 3.44Å; Q334-I385 PolarHBondContact NE2-O 2.87Å; V345-I385 HydrophobicContact CG1-CD1 4.17Å; V345-I385 HydrophobicContact CG2-CD1 3.75Å; V347-I385 HydrophobicContact CG2-CB 3.84Å; V347-I385 HydrophobicContact CG2-CD1 3.98Å; V347-I385 HydrophobicContact CG2-CG1 4.48Å; V347-I385 HydrophobicContact CG2-CG2 4.08Å; L360-I385 HydrophobicContact CD1-CD1 3.75Å
386	E	98.5	Very high	97.4	Very high	15 Å²	15	30.2 Å²	30.2	7%	0.07	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	151.8	170	-171.6	56.2	-74.3	0	0	111.6	I91 V92 L155 K156 V157 L162 I388	I91-E386 WeakPolarHBondContact CA-O 3.49Å; V92-E386 HydrophobicContact CG1-CB 3.94Å; V92-E386 WeakPolarHBondContact CG1-O 3.24Å; V92-E386 PolarHBondContact N-O 3.27Å; V92-E386 PolarHBondContact O-N 2.88Å; L155-E386 HydrophobicContact CB-CB 3.87Å; K156-E386 WeakPolarHBondContact CA-OE2 3.18Å; V157-E386 HydrophobicContact CG2-CG 3.83Å; V157-E386 PolarHBondContact N-OE2 3.35Å; L162-E386 HydrophobicContact CD1-CB 4.06Å; L162-E386 HydrophobicContact CD1-CG 3.9Å; E386-I388 HydrophobicContact CG-CG2 4.22Å
387	L	97.4	Very high	97.3	Very high	24 Å²	24	32.8 Å²	32.8	13%	0.126	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	124.7	169.1	-53.9	98.8	0	0	0	108.7	Y89 R90 I91 Q334 P337 V345	Y89-L387 HydrophobicContact CD1-CD2 4.14Å; Y89-L387 HydrophobicContact CG-CD2 4.05Å; R90-L387 WeakPolarHBondContact O-CA 3.43Å; I91-L387 HydrophobicContact CG2-CD2 4.07Å; I91-L387 HydrophobicContact CG2-CG 4.02Å; Q334-L387 HydrophobicContact CB-CD1 3.38Å; Q334-L387 HydrophobicContact CG-CD1 3.98Å; P337-L387 HydrophobicContact CG-CD2 4.36Å; V345-L387 HydrophobicContact CG1-CD1 4.17Å
388	I	91.7	Very high	97.2	Very high	100 Å²	100	31.1 Å²	31.1	51%	0.513	18%	0.177	S	C	.	.			trans	-118.1	0	-169	57.6	172.6	0	0	0	114	R90 V92 L162 E386	R90-I388 HydrophobicContact CB-CG1 4.14Å; R90-I388 WeakPolarHBondContact CB-O 3.46Å; R90-I388 HydrophobicContact CG-CD1 3.93Å; R90-I388 HydrophobicContact CG-CG1 3.54Å; R90-I388 PolarHBondContact O-N 3.18Å; V92-I388 HydrophobicContact CB-CD1 4.27Å; V92-I388 HydrophobicContact CG1-CD1 4.21Å; V92-I388 HydrophobicContact CG1-CG1 4.43Å; V92-I388 HydrophobicContact CG1-CG2 3.76Å; L162-I388 HydrophobicContact CD1-CG2 4.42Å; L162-I388 HydrophobicContact CD2-CG2 4.39Å; E386-I388 HydrophobicContact CG-CG2 4.22Å

Retrieved 388 of 388 residues in 827.6 ms (Link to these results)

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