A0A068BER6_MOUSE Loading...

MHC class II antigen A alpha

AlphaFold DB , UniProt , Accession A0A068BER6, Species MOUSE (Mus musculus, Mouse), Gene H2-Aa, Length 256 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	35.6	Very low	41.1	Very low	243 Å²	243	152 Å²	152	100%	1.197	82%	0.82	S	S	*	*				0	139.8	0	-75.3	177	172.9	0	0	107.7
2	P	45.4	Very low	41.3	Very low	122 Å²	122	152.3 Å²	152.3	79%	0.792	82%	0.82	S	S	*	*			cis	-108.5	146.3	-1.3	29	-11	0	0	0	111.4
3	R	39	Very low	41.6	Very low	231 Å²	231	147.2 Å²	147.2	87%	0.872	81%	0.81	S	S	*	*				69.4	101.4	65	-159.4	-178	-164.9	164.4	4.6	113.4
4	S	41	Very low	41.6	Very low	106 Å²	106	147.9 Å²	147.9	74%	0.741	81%	0.811	S	S	*	*			trans	159.2	144.9	135	-76.5	0	0	0	0	109
5	R	41.7	Very low	41.7	Very low	227 Å²	227	145.9 Å²	145.9	86%	0.857	81%	0.805	S	S	*	*			cis	-169.8	141.1	-16	-117.3	174	166.4	178.6	-3.9	102.4
6	A	45.5	Very low	42	Very low	89 Å²	89	144.6 Å²	144.6	74%	0.736	80%	0.803	S	S	*	*			trans	-60.6	144.7	173.6	0	0	0	0	0	112.2
7	L	45	Very low	41.9	Very low	154 Å²	154	145 Å²	145	81%	0.806	80%	0.8	S	S	*	*			trans	-163.9	99.6	151	-93.8	135.4	0	0	0	105.4
8	I	41.2	Very low	41.7	Very low	135 Å²	135	145.7 Å²	145.7	69%	0.692	80%	0.801	S	S	*	*				73.4	114.7	84.8	-70.7	177.1	0	0	0	111.9
9	L	37.5	Very low	41.7	Very low	173 Å²	173	143.2 Å²	143.2	91%	0.906	80%	0.795	S	S	*	*			trans	50.1	137.6	153.3	-77.3	86.9	0	0	0	117.9
10	G	37.2	Very low	41.6	Very low	60 Å²	60	145.2 Å²	145.2	62%	0.619	80%	0.803	S	S	*	*			cis	150.8	136.5	19.8	0	0	0	0	0	106.4
11	V	43.4	Very low	41.8	Very low	132 Å²	132	144.1 Å²	144.1	80%	0.8	81%	0.805	S	S	*	*			trans	45.7	114.1	151.3	-148.7	0	0	0	0	118.7
12	L	42.5	Very low	42.3	Very low	156 Å²	156	136.4 Å²	136.4	82%	0.817	79%	0.788	S	S	*	*				168.3	121.6	103.6	-103.7	115.2	0	0	0	109.4	L14	L12-L14 PolarHBondContact O-N 3.23Å
13	A	45.4	Very low	42.2	Very low	85 Å²	85	133.6 Å²	133.6	70%	0.702	78%	0.78	S	S	*	*			trans	-65.5	119.5	165.8	0	0	0	0	0	108.6	T15	A13-T15 VanDerWaalsContact C-N 3.33Å; A13-T15 PolarHBondContact O-N 2.95Å
14	L	41.3	Very low	42.9	Very low	157 Å²	157	131 Å²	131	82%	0.822	78%	0.778	S	S	*	*			trans	-86.6	80	171.5	-157.8	77.8	0	0	0	108.7	L12 T16	L12-L14 PolarHBondContact O-N 3.23Å; L14-T16 HydrophobicContact CG-CG2 4.42Å
15	T	44.2	Very low	43.7	Very low	118 Å²	118	133.3 Å²	133.3	72%	0.724	78%	0.782	S	S	*	*			trans	-95.2	89	160.1	44.3	0	0	0	0	108.1	A13 M17	A13-T15 VanDerWaalsContact C-N 3.33Å; A13-T15 PolarHBondContact O-N 2.95Å; T15-M17 PolarHBondContact O-N 2.85Å
16	T	46.6	Very low	44.9	Very low	125 Å²	125	127.3 Å²	127.3	77%	0.767	77%	0.767	S	S	*	*			trans	-85.7	91.8	163.3	46.4	0	0	0	0	108.1	L14	L14-T16 HydrophobicContact CG-CG2 4.42Å
17	M	39.9	Very low	46.4	Very low	152 Å²	152	130.3 Å²	130.3	75%	0.749	77%	0.769	S	S	*	*			trans	-76.7	136.4	161.4	-87.7	-70.6	-174.2	0	0	109.6	T15	T15-M17 PolarHBondContact O-N 2.85Å
18	L	38.4	Very low	48.1	Very low	158 Å²	158	132.3 Å²	132.3	83%	0.827	77%	0.774	S	S	*	*			trans	77.8	135.2	137.8	-60.9	163.3	0	0	0	120.9
19	S	42	Very low	50.5	Low	98 Å²	98	128.6 Å²	128.6	69%	0.685	76%	0.764	S	S	*	*			trans	79.5	77.3	155.2	-156.1	0	0	0	0	118.5	C21	S19-C21 VanDerWaalsContact C-N 3.3Å; S19-C21 PolarHBondContact O-N 3.42Å
20	L	39.1	Very low	53.3	Low	182 Å²	182	127.9 Å²	127.9	95%	0.953	76%	0.761	S	S	*	*			trans	-87.3	73.8	146.8	-121.5	87	0	0	0	108.2
21	C	45.3	Very low	56	Low	124 Å²	124	130.9 Å²	130.9	84%	0.838	76%	0.759	S	S	*	*			trans	-154.1	58.9	162.6	-85.6	0	0	0	0	107.2	S19	S19-C21 VanDerWaalsContact C-N 3.3Å; S19-C21 PolarHBondContact O-N 3.42Å
22	G	46.9	Very low	58.5	Low	81 Å²	81	128.3 Å²	128.3	84%	0.835	74%	0.743	S	S	*	*			trans	-125.8	103.4	168.3	0	0	0	0	0	106.5
23	G	42	Very low	61.1	Low	62 Å²	62	122.4 Å²	122.4	64%	0.639	72%	0.72	S	S	*	*			trans	-155	62.5	176.7	0	0	0	0	0	107.2	D25	G23-D25 PolarHBondContact O-N 2.89Å
24	E	54.6	Low	63.5	Low	178 Å²	178	120.5 Å²	120.5	83%	0.832	70%	0.701	S	S	*	*			trans	-70.6	83	162.1	-133.7	112.2	127.5	0	0	105.6	D26	E24-D26 PolarHBondContact O-N 3.5Å
25	D	57.2	Low	66.2	Low	154 Å²	154	120.1 Å²	120.1	82%	0.824	69%	0.69	S	S	*	*			trans	-73.3	87.2	166.5	-77	-26.4	0	0	0	106.4	G23 I27	G23-D25 PolarHBondContact O-N 2.89Å; D25-I27 PolarHBondContact O-N 3.24Å
26	D	67.8	Low	68.7	Low	100 Å²	100	115.5 Å²	115.5	54%	0.535	67%	0.666	S	S	.	*			trans	-56.9	120.4	170.9	-93.8	2.5	0	0	0	108.7	E24 E28 R168	E24-D26 PolarHBondContact O-N 3.5Å; D26-E28 PolarHBondContact O-N 2.92Å; D26-E28 VanDerWaalsContact O-N 3.08Å; D26-R168 IonicContact OD1-CZ 3.58Å; D26-R168 IonicContact OD1-NH1 3.78Å; D26-R168 PolarHBondContact OD1-NH1 3.42Å; D26-R168 IonicContact OD2-CZ 2.89Å; D26-R168 IonicContact OD2-NH1 2.77Å; D26-R168 PolarHBondContact OD2-NH1 3.08Å
27	I	77.3	Confident	71.2	Confident	153 Å²	153	111 Å²	111	79%	0.785	64%	0.637	S	S	*	*			trans	-65.6	111.4	173.3	-61.3	174.8	0	0	0	107.4	D25	D25-I27 PolarHBondContact O-N 3.24Å
28	E	80.9	Confident	73.9	Confident	195 Å²	195	106.2 Å²	106.2	91%	0.911	62%	0.618	S	S	*	*			trans	-89.9	115.8	173.9	-167.1	176.8	-178.1	0	0	109.4	D26	D26-E28 PolarHBondContact O-N 2.92Å; D26-E28 VanDerWaalsContact O-N 3.08Å
29	A	90.4	Very high	76.8	Confident	58 Å²	58	99.7 Å²	99.7	48%	0.479	59%	0.585	S	S	.	*			trans	-143.8	150.5	175.2	0	0	0	0	0	109.5	H31 V32	A29-H31 VanDerWaalsContact C-N 3.29Å; A29-H31 PolarHBondContact O-N 3.36Å; A29-V32 HydrophobicContact CB-CG2 4.34Å
30	D	95.8	Very high	79.5	Confident	158 Å²	158	96.7 Å²	96.7	85%	0.845	56%	0.559	S	S	*	*	S	Bend	trans	-64.3	-36.6	177.1	-64.3	-34.1	0	0	0	111.8
31	H	95.3	Very high	82.3	Confident	122 Å²	122	89.5 Å²	89.5	57%	0.565	52%	0.52	S	S	*	.			trans	-146.1	148.2	179.7	-62.3	-68	0	0	0	111.4	A29 F53 D54	A29-H31 VanDerWaalsContact C-N 3.29Å; A29-H31 PolarHBondContact O-N 3.36Å; H31-F53 HydrophobicContact CB-CE2 4.25Å; H31-F53 HydrophobicContact CB-CZ 3.83Å; H31-F53 AromaticContact CG-CZ 3.87Å; H31-F53 AromaticContact ND1-CE1 3.96Å; H31-F53 AromaticContact ND1-CZ 3.82Å; H31-D54 VanDerWaalsContact CA-OD1 3.22Å; H31-D54 WeakPolarHBondContact CA-OD1 3.26Å; H31-D54 IonicContact CE1-OD2 3.45Å; H31-D54 IonicContact CG-OD2 2.73Å; H31-D54 IonicContact ND1-OD1 3.68Å; H31-D54 IonicContact ND1-OD2 3.9Å; H31-D54 PolarHBondContact ND1-OD2 3.45Å
32	V	95.3	Very high	84.7	Confident	79 Å²	79	87 Å²	87	48%	0.479	50%	0.504	S	S	.	.			trans	-129.2	114.8	176.9	-177.8	0	0	0	0	109.9	A29 F53 D54	A29-V32 HydrophobicContact CB-CG2 4.34Å; V32-F53 WeakPolarHBondContact O-CA 3.4Å; V32-D54 PolarHBondContact N-OD1 3.33Å; V32-D54 PolarHBondContact O-N 2.91Å
33	G	96.6	Very high	87	Confident	32 Å²	32	89 Å²	89	33%	0.33	50%	0.502	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	125.4	174.3	0	0	0	0	0	111.9
34	S	97.1	Very high	89.3	Confident	44 Å²	44	89 Å²	89	31%	0.308	50%	0.503	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	92.9	177.2	-65.2	0	0	0	0	110.2	G36 H51 E52	S34-G36 PolarHBondContact O-N 2.96Å; S34-H51 WeakPolarHBondContact O-CA 3.35Å; S34-E52 PolarHBondContact N-O 2.85Å; S34-E52 PolarHBondContact O-N 3.27Å
35	Y	97.2	Very high	91.2	Very high	150 Å²	150	85 Å²	85	59%	0.588	49%	0.487	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.9	82.2	-173.7	-55.7	-69.5	0	0	0	112.4	H51	Y35-H51 AromaticContact CD1-ND1 3.47Å; Y35-H51 WeakPolarHBondContact CD1-ND1 3.45Å
36	G	97.3	Very high	93.1	Very high	20 Å²	20	81.2 Å²	81.2	21%	0.206	47%	0.466	C	S	.	.	E	Extended strand (participates in β ladder)	trans	114.5	45.9	170.9	0	0	0	0	0	114.8	S34 S38 Y49 T50 H51	S34-G36 PolarHBondContact O-N 2.96Å; G36-S38 PolarHBondContact O-N 2.88Å; G36-S38 PolarHBondContact O-OG 3.29Å; G36-S38 VanDerWaalsContact O-OG 3.14Å; G36-Y49 VanDerWaalsContact CA-CE2 3.45Å; G36-Y49 WeakPolarHBondContact CA-OH 3.42Å; G36-T50 CarbonylContact C-O 3.56Å; G36-T50 WeakPolarHBondContact CA-O 3.44Å; G36-T50 PolarHBondContact N-O 3.28Å; G36-H51 PolarHBondContact N-CD2 3.19Å; G36-H51 PolarHBondContact N-NE2 2.89Å
37	I	98.3	Very high	94.5	Very high	31 Å²	31	77.6 Å²	77.6	16%	0.159	45%	0.452	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.8	127.5	169.4	-63.3	166.8	0	0	0	107.7	Y49 T50 E52 V166	I37-Y49 VanDerWaalsContact O-CA 3.3Å; I37-Y49 WeakPolarHBondContact O-CA 3.28Å; I37-T50 PolarHBondContact N-O 3.44Å; I37-T50 PolarHBondContact O-N 3.12Å; I37-E52 HydrophobicContact CD1-CB 4.25Å; I37-E52 HydrophobicContact CD1-CG 3.89Å; I37-E52 VanDerWaalsContact CD1-OE1 3.23Å; I37-E52 WeakPolarHBondContact CD1-OE1 3.37Å; I37-V166 HydrophobicContact CD1-CG2 4.1Å; I37-V166 HydrophobicContact CG2-CG2 3.65Å
38	S	98.1	Very high	95.5	Very high	51 Å²	51	71.6 Å²	71.6	36%	0.357	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	118.6	-175.6	-56.9	0	0	0	0	109.8	G36 Q48 Y49	G36-S38 PolarHBondContact O-N 2.88Å; G36-S38 PolarHBondContact O-OG 3.29Å; G36-S38 VanDerWaalsContact O-OG 3.14Å; S38-Q48 WeakPolarHBondContact CA-O 3.48Å; S38-Y49 VanDerWaalsContact OG-CD2 3.32Å; S38-Y49 WeakPolarHBondContact OG-CD2 3.4Å
39	V	98.3	Very high	96.3	Very high	21 Å²	21	62.7 Å²	62.7	13%	0.127	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	137.2	174.5	-178.5	0	0	0	0	108.4	Q41 G47 Q48 P142 F172	V39-Q41 HydrophobicContact CG1-CG 4.22Å; V39-G47 CarbonylContact O-C 3.54Å; V39-G47 WeakPolarHBondContact O-CA 3.25Å; V39-Q48 HydrophobicContact CB-CB 4.3Å; V39-Q48 PolarHBondContact N-O 3.44Å; V39-Q48 PolarHBondContact O-N 2.94Å; V39-P142 HydrophobicContact CG1-CG 3.83Å; V39-F172 HydrophobicContact CG1-CZ 4.49Å; V39-F172 HydrophobicContact CG2-CE1 3.76Å; V39-F172 HydrophobicContact CG2-CZ 3.85Å
40	Y	98.5	Very high	96.7	Very high	36 Å²	36	60 Å²	60	14%	0.141	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	134	173	-159.5	-89.4	0	0	0	110.4	D45 I46 I90 K94 L97	Y40-D45 WeakPolarHBondContact OH-CA 3.27Å; Y40-D45 VanDerWaalsContact OH-CB 3.25Å; Y40-D45 WeakPolarHBondContact OH-CB 3.32Å; Y40-D45 PolarHBondContact OH-OD1 3.49Å; Y40-I46 CarbonylContact C-O 3.56Å; Y40-I46 WeakPolarHBondContact CA-O 3.48Å; Y40-I90 HydrophobicContact CD2-CG2 3.8Å; Y40-I90 HydrophobicContact CE2-CG2 3.81Å; Y40-K94 HydrophobicContact CD1-CB 3.95Å; Y40-K94 HydrophobicContact CD1-CG 4.32Å; Y40-K94 HydrophobicContact CD2-CB 4.3Å; Y40-K94 HydrophobicContact CE1-CB 3.59Å; Y40-K94 HydrophobicContact CE1-CD 4.18Å; Y40-K94 HydrophobicContact CE1-CG 3.54Å; Y40-K94 HydrophobicContact CE2-CB 3.93Å; Y40-K94 HydrophobicContact CE2-CG 4.43Å; Y40-K94 HydrophobicContact CG-CB 4.29Å; Y40-K94 WeakPolarHBondContact OH-CD 3.35Å; Y40-K94 VanDerWaalsContact OH-CE 3.28Å; Y40-K94 WeakPolarHBondContact OH-CE 3.45Å; Y40-K94 PolarHBondContact OH-NZ 2.68Å; Y40-L97 HydrophobicContact CD1-CD2 3.76Å; Y40-L97 HydrophobicContact CE1-CD2 4.45Å
41	Q	98.1	Very high	96.8	Very high	30 Å²	30	53.2 Å²	53.2	14%	0.14	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	153.3	-171.6	-63.1	163.4	-98.1	0	0	112.2	V39 I46	V39-Q41 HydrophobicContact CG1-CG 4.22Å; Q41-I46 HydrophobicContact CB-CB 4.31Å; Q41-I46 PolarHBondContact N-O 2.86Å; Q41-I46 PolarHBondContact O-N 3.45Å
42	S	96.8	Very high	96.9	Very high	72 Å²	72	48 Å²	48	50%	0.503	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-139.7	144.7	172.6	66.4	0	0	0	0	110.3
43	P	94.4	Very high	97	Very high	122 Å²	122	46.9 Å²	46.9	79%	0.792	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	cis	-72.2	168.4	-0.9	32.3	-36.4	0	0	0	112.9
44	G	90	Very high	96.9	Very high	64 Å²	64	49 Å²	49	66%	0.66	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	104.3	-9.2	173.9	0	0	0	0	0	115.9	I46	G44-I46 VanDerWaalsContact C-N 3.26Å; G44-I46 PolarHBondContact O-N 3.47Å
45	D	94.7	Very high	96.7	Very high	92 Å²	92	49 Å²	49	49%	0.492	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.4	44	-179.9	-81.3	-30.9	0	0	0	112.5	Y40 K94	Y40-D45 WeakPolarHBondContact OH-CA 3.27Å; Y40-D45 VanDerWaalsContact OH-CB 3.25Å; Y40-D45 WeakPolarHBondContact OH-CB 3.32Å; Y40-D45 PolarHBondContact OH-OD1 3.49Å; D45-K94 VanDerWaalsContact OD1-CE 3.22Å; D45-K94 WeakPolarHBondContact OD1-CE 3.39Å; D45-K94 IonicContact OD1-NZ 3.78Å; D45-K94 PolarHBondContact OD1-NZ 2.93Å; D45-K94 IonicContact OD2-NZ 3.05Å; D45-K94 PolarHBondContact OD2-NZ 2.87Å
46	I	96.4	Very high	96.6	Very high	76 Å²	76	46.9 Å²	46.9	39%	0.39	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	125.2	-176.3	-55.9	163.5	0	0	0	108.5	Y40 Q41 G44	Y40-I46 CarbonylContact C-O 3.56Å; Y40-I46 WeakPolarHBondContact CA-O 3.48Å; Q41-I46 HydrophobicContact CB-CB 4.31Å; Q41-I46 PolarHBondContact N-O 2.86Å; Q41-I46 PolarHBondContact O-N 3.45Å; G44-I46 VanDerWaalsContact C-N 3.26Å; G44-I46 PolarHBondContact O-N 3.47Å
47	G	97.3	Very high	96.6	Very high	23 Å²	23	46 Å²	46	24%	0.237	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	151.8	178.5	0	0	0	0	0	112.7	V39 L63	V39-G47 CarbonylContact O-C 3.54Å; V39-G47 WeakPolarHBondContact O-CA 3.25Å; G47-L63 VanDerWaalsContact O-CD1 3.29Å; G47-L63 WeakPolarHBondContact O-CD1 3.33Å
48	Q	98.6	Very high	96.5	Very high	28 Å²	28	48 Å²	48	13%	0.131	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	138	173.2	-173.9	-173.4	-82	0	0	109.6	S38 V39 T50 I90 F164	S38-Q48 WeakPolarHBondContact CA-O 3.48Å; V39-Q48 HydrophobicContact CB-CB 4.3Å; V39-Q48 PolarHBondContact N-O 3.44Å; V39-Q48 PolarHBondContact O-N 2.94Å; Q48-T50 HydrophobicContact CG-CG2 4.1Å; Q48-I90 WeakPolarHBondContact O-CD1 3.45Å; Q48-F164 PolarHBondContact NE2-O 2.96Å
49	Y	98.7	Very high	96.5	Very high	8 Å²	8	45.8 Å²	45.8	3%	0.031	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	122.2	173	-176.8	-89.3	0	0	0	110.3	G36 I37 S38 H51 F59 Y60 V61 F81 N89	G36-Y49 VanDerWaalsContact CA-CE2 3.45Å; G36-Y49 WeakPolarHBondContact CA-OH 3.42Å; I37-Y49 VanDerWaalsContact O-CA 3.3Å; I37-Y49 WeakPolarHBondContact O-CA 3.28Å; S38-Y49 VanDerWaalsContact OG-CD2 3.32Å; S38-Y49 WeakPolarHBondContact OG-CD2 3.4Å; Y49-H51 AromaticContact CE1-CD2 3.63Å; Y49-H51 AromaticContact CE1-NE2 3.56Å; Y49-H51 AromaticContact CZ-CD2 3.94Å; Y49-H51 AromaticContact CZ-NE2 3.58Å; Y49-H51 PolarHBondContact OH-NE2 3.42Å; Y49-F59 HydrophobicContact CE1-CE2 4.35Å; Y49-Y60 CarbonylContact O-C 3.59Å; Y49-Y60 VanDerWaalsContact O-CA 3.24Å; Y49-Y60 WeakPolarHBondContact O-CA 3.29Å; Y49-Y60 WeakPolarHBondContact O-CB 3.41Å; Y49-V61 HydrophobicContact CD1-CB 4.15Å; Y49-V61 HydrophobicContact CD1-CG2 3.61Å; Y49-V61 HydrophobicContact CE1-CG2 4.18Å; Y49-V61 PolarHBondContact O-N 3.27Å; Y49-F81 HydrophobicContact CD1-CE1 4.45Å; Y49-F81 AromaticContact CE1-CE1 3.68Å; Y49-F81 HydrophobicContact CE1-CE1 3.68Å; Y49-F81 HydrophobicContact CE1-CE2 4.47Å; Y49-F81 AromaticContact CE1-CZ 3.54Å; Y49-F81 HydrophobicContact CE1-CZ 3.54Å; Y49-F81 AromaticContact CZ-CZ 3.82Å; Y49-F81 WeakPolarHBondContact OH-CZ 3.45Å; Y49-N89 HydrophobicContact CD2-CB 4.09Å; Y49-N89 HydrophobicContact CE2-CB 3.89Å
50	T	98.6	Very high	96.6	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	154	-176.3	47.7	0	0	0	0	112.4	G36 I37 Q48 F59	G36-T50 CarbonylContact C-O 3.56Å; G36-T50 WeakPolarHBondContact CA-O 3.44Å; G36-T50 PolarHBondContact N-O 3.28Å; I37-T50 PolarHBondContact N-O 3.44Å; I37-T50 PolarHBondContact O-N 3.12Å; Q48-T50 HydrophobicContact CG-CG2 4.1Å; T50-F59 WeakPolarHBondContact CA-O 3.42Å
51	H	98.3	Very high	96.6	Very high	16 Å²	16	46.8 Å²	46.8	7%	0.074	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	136.6	162.5	-78.5	-146	0	0	0	108.7	S34 Y35 G36 Y49 W58 F59 F81	S34-H51 WeakPolarHBondContact O-CA 3.35Å; Y35-H51 AromaticContact CD1-ND1 3.47Å; Y35-H51 WeakPolarHBondContact CD1-ND1 3.45Å; G36-H51 PolarHBondContact N-CD2 3.19Å; G36-H51 PolarHBondContact N-NE2 2.89Å; Y49-H51 AromaticContact CE1-CD2 3.63Å; Y49-H51 AromaticContact CE1-NE2 3.56Å; Y49-H51 AromaticContact CZ-CD2 3.94Å; Y49-H51 AromaticContact CZ-NE2 3.58Å; Y49-H51 PolarHBondContact OH-NE2 3.42Å; H51-W58 HydrophobicContact CB-CB 4.34Å; H51-W58 PolarHBondContact O-N 2.92Å; H51-F59 HydrophobicContact CB-CD1 4.01Å; H51-F59 HydrophobicContact CB-CE1 3.6Å; H51-F59 HydrophobicContact CB-CE2 4.21Å; H51-F59 HydrophobicContact CB-CG 4.49Å; H51-F59 HydrophobicContact CB-CZ 3.72Å; H51-F59 AromaticContact CD2-CE2 3.72Å; H51-F59 AromaticContact CD2-CZ 3.44Å; H51-F59 VanDerWaalsContact CD2-CZ 3.44Å; H51-F59 WeakPolarHBondContact CD2-CZ 3.23Å; H51-F59 AromaticContact CE1-CZ 3.59Å; H51-F59 AromaticContact CG-CE1 3.54Å; H51-F59 AromaticContact CG-CE2 3.85Å; H51-F59 AromaticContact CG-CZ 3.21Å; H51-F59 PolarHBondContact N-O 3Å; H51-F59 AromaticContact ND1-CE1 3.54Å; H51-F59 AromaticContact ND1-CZ 3.31Å; H51-F59 VanDerWaalsContact ND1-CZ 3.31Å; H51-F59 WeakPolarHBondContact ND1-CZ 3.28Å; H51-F59 AromaticContact NE2-CZ 3.67Å; H51-F81 AromaticContact CE1-CE2 3.81Å; H51-F81 AromaticContact NE2-CE2 3.76Å
52	E	97.4	Very high	96.6	Very high	12 Å²	12	46.4 Å²	46.4	6%	0.056	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	148.5	-179.9	-63.9	171.4	-154.5	0	0	110.1	S34 I37 D56 L165	S34-E52 PolarHBondContact N-O 2.85Å; S34-E52 PolarHBondContact O-N 3.27Å; I37-E52 HydrophobicContact CD1-CB 4.25Å; I37-E52 HydrophobicContact CD1-CG 3.89Å; I37-E52 VanDerWaalsContact CD1-OE1 3.23Å; I37-E52 WeakPolarHBondContact CD1-OE1 3.37Å; E52-D56 CarbonylContact C-O 3.58Å; E52-D56 VanDerWaalsContact CA-O 3.25Å; E52-D56 WeakPolarHBondContact CA-O 3.45Å; E52-L165 HydrophobicContact CG-CD2 4.15Å
53	F	96.2	Very high	96.6	Very high	56 Å²	56	44.7 Å²	44.7	25%	0.246	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	124.6	174.5	-173.5	-92.2	0	0	0	109.3	H31 V32 G55 D56 W58	H31-F53 HydrophobicContact CB-CE2 4.25Å; H31-F53 HydrophobicContact CB-CZ 3.83Å; H31-F53 AromaticContact CG-CZ 3.87Å; H31-F53 AromaticContact ND1-CE1 3.96Å; H31-F53 AromaticContact ND1-CZ 3.82Å; V32-F53 WeakPolarHBondContact O-CA 3.4Å; F53-G55 PolarHBondContact O-N 3.36Å; F53-G55 VanDerWaalsContact O-N 3.08Å; F53-D56 PolarHBondContact N-O 3.47Å; F53-D56 PolarHBondContact O-N 3.48Å; F53-W58 HydrophobicContact CB-CD2 4.38Å; F53-W58 HydrophobicContact CB-CG 4.37Å; F53-W58 HydrophobicContact CB-CZ2 4.13Å; F53-W58 HydrophobicContact CD1-CZ2 4.44Å; F53-W58 HydrophobicContact CD2-CZ2 4.43Å; F53-W58 HydrophobicContact CG-CZ2 4.08Å; F53-W58 AromaticContact CG-NE1 3.89Å
54	D	94.9	Very high	96.8	Very high	77 Å²	77	46.2 Å²	46.2	41%	0.412	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.8	28.6	-176.6	-63.7	-13.1	0	0	0	114	H31 V32	H31-D54 VanDerWaalsContact CA-OD1 3.22Å; H31-D54 WeakPolarHBondContact CA-OD1 3.26Å; H31-D54 IonicContact CE1-OD2 3.45Å; H31-D54 IonicContact CG-OD2 2.73Å; H31-D54 IonicContact ND1-OD1 3.68Å; H31-D54 IonicContact ND1-OD2 3.9Å; H31-D54 PolarHBondContact ND1-OD2 3.45Å; V32-D54 PolarHBondContact N-OD1 3.33Å; V32-D54 PolarHBondContact O-N 2.91Å
55	G	92.7	Very high	97.2	Very high	44 Å²	44	49.7 Å²	49.7	45%	0.454	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	91.5	-7.7	-179.1	0	0	0	0	0	115	F53	F53-G55 PolarHBondContact O-N 3.36Å; F53-G55 VanDerWaalsContact O-N 3.08Å
56	D	95.5	Very high	97.3	Very high	105 Å²	105	51.3 Å²	51.3	56%	0.561	26%	0.261	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.6	137.2	176.9	-73.8	-48.5	0	0	0	111.9	E52 F53 W58 M71	E52-D56 CarbonylContact C-O 3.58Å; E52-D56 VanDerWaalsContact CA-O 3.25Å; E52-D56 WeakPolarHBondContact CA-O 3.45Å; F53-D56 PolarHBondContact N-O 3.47Å; F53-D56 PolarHBondContact O-N 3.48Å; D56-W58 PolarHBondContact O-N 3.41Å; D56-M71 HydrophobicContact CB-CE 4.26Å
57	E	97.4	Very high	97.4	Very high	3 Å²	3	53 Å²	53	1%	0.014	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.1	118.7	172.4	-170	176.5	-179.5	0	0	110.9	Y60 M71 T162 S163 L165	E57-Y60 WeakPolarHBondContact OE1-CD1 3.24Å; E57-M71 HydrophobicContact CB-CE 4.1Å; E57-M71 WeakPolarHBondContact O-CB 3.5Å; E57-M71 WeakPolarHBondContact O-CE 3.46Å; E57-T162 WeakPolarHBondContact OE2-CB 3.29Å; E57-S163 WeakPolarHBondContact OE1-CB 3.29Å; E57-S163 PolarHBondContact OE1-OG 2.95Å; E57-S163 PolarHBondContact OE2-N 3.3Å; E57-L165 HydrophobicContact CB-CD2 3.82Å; E57-L165 HydrophobicContact CG-CD2 4.27Å
58	W	96.6	Very high	97.5	Very high	73 Å²	73	53.3 Å²	53.3	28%	0.277	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	-52.3	172.4	-90.2	35.8	0	0	0	111.7	H51 F53 D56 W70 M71	H51-W58 HydrophobicContact CB-CB 4.34Å; H51-W58 PolarHBondContact O-N 2.92Å; F53-W58 HydrophobicContact CB-CD2 4.38Å; F53-W58 HydrophobicContact CB-CG 4.37Å; F53-W58 HydrophobicContact CB-CZ2 4.13Å; F53-W58 HydrophobicContact CD1-CZ2 4.44Å; F53-W58 HydrophobicContact CD2-CZ2 4.43Å; F53-W58 HydrophobicContact CG-CZ2 4.08Å; F53-W58 AromaticContact CG-NE1 3.89Å; D56-W58 PolarHBondContact O-N 3.41Å; W58-W70 HydrophobicContact CE3-CZ3 4.22Å; W58-M71 PolarHBondContact O-N 2.99Å
59	F	98.1	Very high	97.4	Very high	4 Å²	4	54.1 Å²	54.1	2%	0.018	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.4	160.9	177.8	65.5	-97.9	0	0	0	110.5	Y49 T50 H51 V61 T68 V69 W70 F81	Y49-F59 HydrophobicContact CE1-CE2 4.35Å; T50-F59 WeakPolarHBondContact CA-O 3.42Å; H51-F59 HydrophobicContact CB-CD1 4.01Å; H51-F59 HydrophobicContact CB-CE1 3.6Å; H51-F59 HydrophobicContact CB-CE2 4.21Å; H51-F59 HydrophobicContact CB-CG 4.49Å; H51-F59 HydrophobicContact CB-CZ 3.72Å; H51-F59 AromaticContact CD2-CE2 3.72Å; H51-F59 AromaticContact CD2-CZ 3.44Å; H51-F59 VanDerWaalsContact CD2-CZ 3.44Å; H51-F59 WeakPolarHBondContact CD2-CZ 3.23Å; H51-F59 AromaticContact CE1-CZ 3.59Å; H51-F59 AromaticContact CG-CE1 3.54Å; H51-F59 AromaticContact CG-CE2 3.85Å; H51-F59 AromaticContact CG-CZ 3.21Å; H51-F59 PolarHBondContact N-O 3Å; H51-F59 AromaticContact ND1-CE1 3.54Å; H51-F59 AromaticContact ND1-CZ 3.31Å; H51-F59 VanDerWaalsContact ND1-CZ 3.31Å; H51-F59 WeakPolarHBondContact ND1-CZ 3.28Å; H51-F59 AromaticContact NE2-CZ 3.67Å; F59-V61 HydrophobicContact CE2-CG2 4.46Å; F59-T68 HydrophobicContact CB-CG2 4.01Å; F59-T68 HydrophobicContact CD1-CG2 4.41Å; F59-T68 HydrophobicContact CD2-CG2 3.55Å; F59-T68 HydrophobicContact CE2-CG2 4.05Å; F59-T68 HydrophobicContact CG-CG2 3.75Å; F59-V69 WeakPolarHBondContact CA-O 3.39Å; F59-V69 WeakPolarHBondContact CB-O 3.3Å; F59-W70 HydrophobicContact CB-CD2 4.1Å; F59-W70 HydrophobicContact CB-CE3 3.98Å; F59-W70 HydrophobicContact CB-CG 4.44Å; F59-W70 HydrophobicContact CB-CZ3 4.42Å; F59-W70 HydrophobicContact CD1-CD2 4.43Å; F59-W70 AromaticContact CD1-CE3 3.85Å; F59-W70 HydrophobicContact CD1-CE3 3.85Å; F59-W70 AromaticContact CD1-CH2 3.58Å; F59-W70 HydrophobicContact CD1-CH2 3.58Å; F59-W70 HydrophobicContact CD1-CZ2 4.19Å; F59-W70 AromaticContact CD1-CZ3 3.41Å; F59-W70 HydrophobicContact CD1-CZ3 3.41Å; F59-W70 VanDerWaalsContact CD1-CZ3 3.41Å; F59-W70 AromaticContact CE1-CH2 3.85Å; F59-W70 HydrophobicContact CE1-CH2 3.85Å; F59-W70 HydrophobicContact CE1-CZ3 4.06Å; F59-W70 HydrophobicContact CG-CE3 4.34Å; F59-W70 HydrophobicContact CG-CH2 4.48Å; F59-W70 HydrophobicContact CG-CZ3 4.3Å; F59-F81 HydrophobicContact CE1-CB 4.1Å; F59-F81 HydrophobicContact CE1-CG 4.32Å; F59-F81 HydrophobicContact CE2-CB 4.04Å; F59-F81 AromaticContact CE2-CD1 3.53Å; F59-F81 HydrophobicContact CE2-CD1 3.53Å; F59-F81 HydrophobicContact CE2-CD2 4.26Å; F59-F81 HydrophobicContact CE2-CE1 4.01Å; F59-F81 AromaticContact CE2-CG 3.68Å; F59-F81 HydrophobicContact CE2-CG 3.68Å; F59-F81 HydrophobicContact CZ-CB 3.61Å; F59-F81 AromaticContact CZ-CD1 3.77Å; F59-F81 HydrophobicContact CZ-CD1 3.77Å; F59-F81 AromaticContact CZ-CD2 3.66Å; F59-F81 HydrophobicContact CZ-CD2 3.66Å; F59-F81 HydrophobicContact CZ-CE1 4.35Å; F59-F81 HydrophobicContact CZ-CE2 4.25Å; F59-F81 AromaticContact CZ-CG 3.39Å; F59-F81 HydrophobicContact CZ-CG 3.39Å
60	Y	98.6	Very high	97.4	Very high	72 Å²	72	55.7 Å²	55.7	28%	0.282	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	163.7	162.1	69.6	-86.1	0	0	0	110.7	Y49 E57 D62 V69 S163	Y49-Y60 CarbonylContact O-C 3.59Å; Y49-Y60 VanDerWaalsContact O-CA 3.24Å; Y49-Y60 WeakPolarHBondContact O-CA 3.29Å; Y49-Y60 WeakPolarHBondContact O-CB 3.41Å; E57-Y60 WeakPolarHBondContact OE1-CD1 3.24Å; Y60-D62 HydrophobicContact CE2-CB 4.11Å; Y60-V69 HydrophobicContact CD1-CB 4.01Å; Y60-V69 HydrophobicContact CD1-CG1 4.31Å; Y60-V69 HydrophobicContact CD2-CB 4.38Å; Y60-V69 HydrophobicContact CE1-CB 3.58Å; Y60-V69 HydrophobicContact CE1-CG1 3.51Å; Y60-V69 HydrophobicContact CE1-CG2 4.35Å; Y60-V69 HydrophobicContact CE2-CB 3.96Å; Y60-V69 HydrophobicContact CE2-CG2 3.92Å; Y60-V69 HydrophobicContact CG-CB 4.4Å; Y60-V69 PolarHBondContact N-O 3.45Å; Y60-V69 PolarHBondContact O-N 3.07Å; Y60-S163 WeakPolarHBondContact CB-OG 3.23Å
61	V	98.7	Very high	97.2	Very high	5 Å²	5	58.6 Å²	58.6	3%	0.03	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	117.9	168.3	176.2	0	0	0	0	108.6	Y49 F59 L63 E67 F81 P83	Y49-V61 HydrophobicContact CD1-CB 4.15Å; Y49-V61 HydrophobicContact CD1-CG2 3.61Å; Y49-V61 HydrophobicContact CE1-CG2 4.18Å; Y49-V61 PolarHBondContact O-N 3.27Å; F59-V61 HydrophobicContact CE2-CG2 4.46Å; V61-L63 HydrophobicContact CB-CD2 4.38Å; V61-L63 HydrophobicContact CG1-CD2 4.06Å; V61-L63 PolarHBondContact O-N 3.35Å; V61-L63 VanDerWaalsContact O-N 3.08Å; V61-E67 CarbonylContact C-O 3.57Å; V61-E67 WeakPolarHBondContact CA-O 2.91Å; V61-F81 HydrophobicContact CG2-CD1 4.11Å; V61-F81 HydrophobicContact CG2-CE1 3.82Å; V61-P83 HydrophobicContact CG1-CB 3.73Å; V61-P83 HydrophobicContact CG2-CB 4.34Å
62	D	98.3	Very high	97	Very high	22 Å²	22	61.3 Å²	61.3	12%	0.118	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	105.1	166.4	-175.4	-37.3	0	0	0	107.1	Y60 D64 K65 K66 E67 V69	Y60-D62 HydrophobicContact CE2-CB 4.11Å; D62-D64 VanDerWaalsContact C-N 3.27Å; D62-D64 PolarHBondContact O-N 3.03Å; D62-D64 PolarHBondContact OD1-N 2.9Å; D62-D64 VanDerWaalsContact OD1-N 3.15Å; D62-K65 HydrophobicContact CB-CB 4.18Å; D62-K65 PolarHBondContact OD1-N 3.03Å; D62-K65 WeakPolarHBondContact OD2-CD 3.28Å; D62-K65 WeakPolarHBondContact OD2-CG 3.41Å; D62-K65 IonicContact OD2-NZ 3.2Å; D62-K65 PolarHBondContact OD2-NZ 3.26Å; D62-K66 WeakPolarHBondContact O-CA 3.5Å; D62-K66 PolarHBondContact O-N 3.45Å; D62-E67 PolarHBondContact N-O 2.85Å; D62-E67 PolarHBondContact O-N 3.42Å; D62-V69 HydrophobicContact CB-CG2 4.12Å
63	L	98.1	Very high	96.7	Very high	37 Å²	37	65 Å²	65	19%	0.194	33%	0.331	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-26.6	-172.2	-57.8	177.2	0	0	0	112.4	G47 V61 L87 I90	G47-L63 VanDerWaalsContact O-CD1 3.29Å; G47-L63 WeakPolarHBondContact O-CD1 3.33Å; V61-L63 HydrophobicContact CB-CD2 4.38Å; V61-L63 HydrophobicContact CG1-CD2 4.06Å; V61-L63 PolarHBondContact O-N 3.35Å; V61-L63 VanDerWaalsContact O-N 3.08Å; L63-L87 HydrophobicContact CB-CD2 4.31Å; L63-L87 HydrophobicContact CD2-CD2 3.92Å; L63-I90 HydrophobicContact CD1-CD1 4.22Å; L63-I90 HydrophobicContact CD1-CG1 3.93Å; L63-I90 HydrophobicContact CD1-CG2 4.23Å; L63-I90 HydrophobicContact CD2-CG1 3.8Å
64	D	97.3	Very high	96.7	Very high	154 Å²	154	67.4 Å²	67.4	82%	0.824	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.1	-48.8	179.8	-69.7	-35.9	0	0	0	110.6	D62 K66	D62-D64 VanDerWaalsContact C-N 3.27Å; D62-D64 PolarHBondContact O-N 3.03Å; D62-D64 PolarHBondContact OD1-N 2.9Å; D62-D64 VanDerWaalsContact OD1-N 3.15Å; D64-K66 VanDerWaalsContact C-N 3.31Å
65	K	98.2	Very high	96.6	Very high	137 Å²	137	67.1 Å²	67.1	60%	0.596	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.3	-20.9	176.8	-60.2	-166.9	-163.2	101.7	0	112.9	D62 E67	D62-K65 HydrophobicContact CB-CB 4.18Å; D62-K65 PolarHBondContact OD1-N 3.03Å; D62-K65 WeakPolarHBondContact OD2-CD 3.28Å; D62-K65 WeakPolarHBondContact OD2-CG 3.41Å; D62-K65 IonicContact OD2-NZ 3.2Å; D62-K65 PolarHBondContact OD2-NZ 3.26Å; K65-E67 HydrophobicContact CB-CB 4.4Å; K65-E67 HydrophobicContact CB-CG 4.2Å
66	K	98.2	Very high	96.6	Very high	126 Å²	126	66.6 Å²	66.6	55%	0.548	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.2	48.1	-176.5	-46.8	178.1	-177.9	168.7	0	111.3	D62 D64 P83 L87	D62-K66 WeakPolarHBondContact O-CA 3.5Å; D62-K66 PolarHBondContact O-N 3.45Å; D64-K66 VanDerWaalsContact C-N 3.31Å; K66-P83 WeakPolarHBondContact O-CB 3.45Å; K66-P83 WeakPolarHBondContact O-CG 3.31Å; K66-L87 HydrophobicContact CB-CD1 4.09Å; K66-L87 HydrophobicContact CD-CD1 4.03Å; K66-L87 HydrophobicContact CG-CD1 3.92Å
67	E	98	Very high	96.6	Very high	111 Å²	111	69.3 Å²	69.3	52%	0.519	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	146.6	-175.4	-69.2	178.5	167.3	0	0	110.6	V61 D62 K65	V61-E67 CarbonylContact C-O 3.57Å; V61-E67 WeakPolarHBondContact CA-O 2.91Å; D62-E67 PolarHBondContact N-O 2.85Å; D62-E67 PolarHBondContact O-N 3.42Å; K65-E67 HydrophobicContact CB-CB 4.4Å; K65-E67 HydrophobicContact CB-CG 4.2Å
68	T	98.4	Very high	96.5	Very high	29 Å²	29	76.3 Å²	76.3	18%	0.178	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	119.4	172.5	-57.8	0	0	0	0	108.6	F59 W70 F81	F59-T68 HydrophobicContact CB-CG2 4.01Å; F59-T68 HydrophobicContact CD1-CG2 4.41Å; F59-T68 HydrophobicContact CD2-CG2 3.55Å; F59-T68 HydrophobicContact CE2-CG2 4.05Å; F59-T68 HydrophobicContact CG-CG2 3.75Å; T68-W70 HydrophobicContact CG2-CZ2 4.1Å; T68-F81 HydrophobicContact CG2-CB 4.02Å; T68-F81 HydrophobicContact CG2-CD1 4.45Å; T68-F81 PolarHBondContact OG1-O 2.91Å
69	V	98.1	Very high	96.5	Very high	46 Å²	46	76 Å²	76	28%	0.279	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	109.3	-179.9	-176.1	0	0	0	0	109.2	F59 Y60 D62	F59-V69 WeakPolarHBondContact CA-O 3.39Å; F59-V69 WeakPolarHBondContact CB-O 3.3Å; Y60-V69 HydrophobicContact CD1-CB 4.01Å; Y60-V69 HydrophobicContact CD1-CG1 4.31Å; Y60-V69 HydrophobicContact CD2-CB 4.38Å; Y60-V69 HydrophobicContact CE1-CB 3.58Å; Y60-V69 HydrophobicContact CE1-CG1 3.51Å; Y60-V69 HydrophobicContact CE1-CG2 4.35Å; Y60-V69 HydrophobicContact CE2-CB 3.96Å; Y60-V69 HydrophobicContact CE2-CG2 3.92Å; Y60-V69 HydrophobicContact CG-CB 4.4Å; Y60-V69 PolarHBondContact N-O 3.45Å; Y60-V69 PolarHBondContact O-N 3.07Å; D62-V69 HydrophobicContact CB-CG2 4.12Å
70	W	97.6	Very high	96.4	Very high	40 Å²	40	80.8 Å²	80.8	15%	0.152	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	134.6	179.5	-62.2	89.3	0	0	0	111.2	W58 F59 T68 L72 F75 T79	W58-W70 HydrophobicContact CE3-CZ3 4.22Å; F59-W70 HydrophobicContact CB-CD2 4.1Å; F59-W70 HydrophobicContact CB-CE3 3.98Å; F59-W70 HydrophobicContact CB-CG 4.44Å; F59-W70 HydrophobicContact CB-CZ3 4.42Å; F59-W70 HydrophobicContact CD1-CD2 4.43Å; F59-W70 AromaticContact CD1-CE3 3.85Å; F59-W70 HydrophobicContact CD1-CE3 3.85Å; F59-W70 AromaticContact CD1-CH2 3.58Å; F59-W70 HydrophobicContact CD1-CH2 3.58Å; F59-W70 HydrophobicContact CD1-CZ2 4.19Å; F59-W70 AromaticContact CD1-CZ3 3.41Å; F59-W70 HydrophobicContact CD1-CZ3 3.41Å; F59-W70 VanDerWaalsContact CD1-CZ3 3.41Å; F59-W70 AromaticContact CE1-CH2 3.85Å; F59-W70 HydrophobicContact CE1-CH2 3.85Å; F59-W70 HydrophobicContact CE1-CZ3 4.06Å; F59-W70 HydrophobicContact CG-CE3 4.34Å; F59-W70 HydrophobicContact CG-CH2 4.48Å; F59-W70 HydrophobicContact CG-CZ3 4.3Å; T68-W70 HydrophobicContact CG2-CZ2 4.1Å; W70-L72 VanDerWaalsContact C-N 3.31Å; W70-L72 WeakPolarHBondContact CB-O 3.21Å; W70-L72 PolarHBondContact O-N 3.28Å; W70-F75 HydrophobicContact CD2-CB 4.29Å; W70-F75 HydrophobicContact CE3-CB 3.65Å; W70-F75 HydrophobicContact CZ3-CB 4.13Å; W70-T79 HydrophobicContact CH2-CG2 3.36Å; W70-T79 HydrophobicContact CZ2-CG2 4.04Å; W70-T79 HydrophobicContact CZ3-CG2 3.73Å
71	M	94.7	Very high	96.4	Very high	61 Å²	61	79.8 Å²	79.8	30%	0.3	42%	0.417	S	S	.	.	S	Bend	trans	-61.7	-43	175.6	-170.7	-118.3	-84	0	0	110.8	D56 E57 W58	D56-M71 HydrophobicContact CB-CE 4.26Å; E57-M71 HydrophobicContact CB-CE 4.1Å; E57-M71 WeakPolarHBondContact O-CB 3.5Å; E57-M71 WeakPolarHBondContact O-CE 3.46Å; W58-M71 PolarHBondContact O-N 2.99Å
72	L	93.6	Very high	96.4	Very high	73 Å²	73	84.9 Å²	84.9	38%	0.382	44%	0.444	S	S	.	.	S	Bend	trans	-108.4	114.7	170.2	-65.1	179.5	0	0	0	109.6	W70 E74 F75	W70-L72 VanDerWaalsContact C-N 3.31Å; W70-L72 WeakPolarHBondContact CB-O 3.21Å; W70-L72 PolarHBondContact O-N 3.28Å; L72-E74 PolarHBondContact O-N 3.23Å; L72-E74 VanDerWaalsContact O-N 3.1Å; L72-F75 HydrophobicContact CB-CD2 3.97Å; L72-F75 HydrophobicContact CB-CE2 4.14Å; L72-F75 HydrophobicContact CB-CG 4.18Å; L72-F75 HydrophobicContact CB-CZ 4.49Å; L72-F75 HydrophobicContact CD1-CD2 4.5Å; L72-F75 HydrophobicContact CD1-CE1 4.27Å; L72-F75 HydrophobicContact CD1-CE2 3.82Å; L72-F75 HydrophobicContact CD1-CZ 3.7Å; L72-F75 HydrophobicContact CG-CE2 4.35Å; L72-F75 WeakPolarHBondContact O-CB 3.42Å; L72-F75 PolarHBondContact O-N 3.33Å
73	P	92.4	Very high	96.4	Very high	89 Å²	89	85.1 Å²	85.1	58%	0.578	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.1	-27.6	-177.7	-26.8	35.1	0	0	0	114.2	F75 G76	P73-F75 PolarHBondContact O-N 2.92Å; P73-G76 PolarHBondContact O-N 2.88Å
74	E	95.2	Very high	96.4	Very high	108 Å²	108	87.4 Å²	87.4	51%	0.505	46%	0.457	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-33	177.3	-60.2	79.4	-172	0	0	112	L72 G76 Q77	L72-E74 PolarHBondContact O-N 3.23Å; L72-E74 VanDerWaalsContact O-N 3.1Å; E74-G76 VanDerWaalsContact C-N 3.31Å; E74-G76 PolarHBondContact O-N 3.38Å; E74-Q77 WeakPolarHBondContact O-CB 3.07Å; E74-Q77 PolarHBondContact O-N 3.48Å; E74-Q77 VanDerWaalsContact O-N 3.1Å
75	F	93.3	Very high	96.4	Very high	70 Å²	70	81.2 Å²	81.2	31%	0.307	43%	0.429	S	S	.	.	H	α-helix	trans	-65.3	-35.9	177.7	-66.7	-12.8	0	0	0	112	W70 L72 P73 Q77 L78 T79	W70-F75 HydrophobicContact CD2-CB 4.29Å; W70-F75 HydrophobicContact CE3-CB 3.65Å; W70-F75 HydrophobicContact CZ3-CB 4.13Å; L72-F75 HydrophobicContact CB-CD2 3.97Å; L72-F75 HydrophobicContact CB-CE2 4.14Å; L72-F75 HydrophobicContact CB-CG 4.18Å; L72-F75 HydrophobicContact CB-CZ 4.49Å; L72-F75 HydrophobicContact CD1-CD2 4.5Å; L72-F75 HydrophobicContact CD1-CE1 4.27Å; L72-F75 HydrophobicContact CD1-CE2 3.82Å; L72-F75 HydrophobicContact CD1-CZ 3.7Å; L72-F75 HydrophobicContact CG-CE2 4.35Å; L72-F75 WeakPolarHBondContact O-CB 3.42Å; L72-F75 PolarHBondContact O-N 3.33Å; P73-F75 PolarHBondContact O-N 2.92Å; F75-Q77 PolarHBondContact O-N 3.42Å; F75-Q77 VanDerWaalsContact O-N 3.15Å; F75-L78 PolarHBondContact O-N 3.48Å; F75-T79 WeakPolarHBondContact O-CG2 3.28Å; F75-T79 PolarHBondContact O-N 2.8Å
76	G	92.4	Very high	96.4	Very high	34 Å²	34	74.7 Å²	74.7	35%	0.351	40%	0.401	S	S	.	.	H	α-helix	trans	-66.2	-11.3	174.5	0	0	0	0	0	114.6	P73 E74 T79	P73-G76 PolarHBondContact O-N 2.88Å; E74-G76 VanDerWaalsContact C-N 3.31Å; E74-G76 PolarHBondContact O-N 3.38Å; G76-T79 CarbonylContact C-O 3.6Å
77	Q	95.1	Very high	96.4	Very high	162 Å²	162	70.3 Å²	70.3	76%	0.757	38%	0.383	S	S	*	.	H	α-helix	trans	-89.2	-22.8	172	-55.7	178.9	22.1	0	0	112.4	E74 F75	E74-Q77 WeakPolarHBondContact O-CB 3.07Å; E74-Q77 PolarHBondContact O-N 3.48Å; E74-Q77 VanDerWaalsContact O-N 3.1Å; F75-Q77 PolarHBondContact O-N 3.42Å; F75-Q77 VanDerWaalsContact O-N 3.15Å
78	L	95.9	Very high	96.4	Very high	149 Å²	149	71.6 Å²	71.6	78%	0.78	39%	0.387	S	S	*	.	H	α-helix	trans	-98	-28.6	-175.4	-61.5	176.7	0	0	0	112.6	F75	F75-L78 PolarHBondContact O-N 3.48Å
79	T	95.9	Very high	96.4	Very high	66 Å²	66	73.5 Å²	73.5	41%	0.405	40%	0.396	S	S	.	.			trans	-145.9	172.1	-177.3	-174.3	0	0	0	0	110.9	W70 F75 G76	W70-T79 HydrophobicContact CH2-CG2 3.36Å; W70-T79 HydrophobicContact CZ2-CG2 4.04Å; W70-T79 HydrophobicContact CZ3-CG2 3.73Å; F75-T79 WeakPolarHBondContact O-CG2 3.28Å; F75-T79 PolarHBondContact O-N 2.8Å; G76-T79 CarbonylContact C-O 3.6Å
80	S	96.7	Very high	96.5	Very high	105 Å²	105	72 Å²	72	73%	0.734	39%	0.387	S	S	*	.			trans	-145	156	-179.5	65.8	0	0	0	0	111.2
81	F	98.1	Very high	96.5	Very high	51 Å²	51	73 Å²	73	22%	0.224	40%	0.404	C	S	.	.			trans	-137	132.4	171.8	179.5	-97	0	0	0	109.2	Y49 H51 F59 V61 T68 P83	Y49-F81 HydrophobicContact CD1-CE1 4.45Å; Y49-F81 AromaticContact CE1-CE1 3.68Å; Y49-F81 HydrophobicContact CE1-CE1 3.68Å; Y49-F81 HydrophobicContact CE1-CE2 4.47Å; Y49-F81 AromaticContact CE1-CZ 3.54Å; Y49-F81 HydrophobicContact CE1-CZ 3.54Å; Y49-F81 AromaticContact CZ-CZ 3.82Å; Y49-F81 WeakPolarHBondContact OH-CZ 3.45Å; H51-F81 AromaticContact CE1-CE2 3.81Å; H51-F81 AromaticContact NE2-CE2 3.76Å; F59-F81 HydrophobicContact CE1-CB 4.1Å; F59-F81 HydrophobicContact CE1-CG 4.32Å; F59-F81 HydrophobicContact CE2-CB 4.04Å; F59-F81 AromaticContact CE2-CD1 3.53Å; F59-F81 HydrophobicContact CE2-CD1 3.53Å; F59-F81 HydrophobicContact CE2-CD2 4.26Å; F59-F81 HydrophobicContact CE2-CE1 4.01Å; F59-F81 AromaticContact CE2-CG 3.68Å; F59-F81 HydrophobicContact CE2-CG 3.68Å; F59-F81 HydrophobicContact CZ-CB 3.61Å; F59-F81 AromaticContact CZ-CD1 3.77Å; F59-F81 HydrophobicContact CZ-CD1 3.77Å; F59-F81 AromaticContact CZ-CD2 3.66Å; F59-F81 HydrophobicContact CZ-CD2 3.66Å; F59-F81 HydrophobicContact CZ-CE1 4.35Å; F59-F81 HydrophobicContact CZ-CE2 4.25Å; F59-F81 AromaticContact CZ-CG 3.39Å; F59-F81 HydrophobicContact CZ-CG 3.39Å; V61-F81 HydrophobicContact CG2-CD1 4.11Å; V61-F81 HydrophobicContact CG2-CE1 3.82Å; T68-F81 HydrophobicContact CG2-CB 4.02Å; T68-F81 HydrophobicContact CG2-CD1 4.45Å; T68-F81 PolarHBondContact OG1-O 2.91Å; F81-P83 WeakPolarHBondContact O-CD 3.5Å
82	D	98.3	Very high	96.7	Very high	112 Å²	112	73.6 Å²	73.6	60%	0.599	41%	0.411	S	S	*	.			trans	-76.6	112	174.5	177.6	-0.3	0	0	0	109.5	Q84 G85	D82-Q84 PolarHBondContact O-N 3.48Å; D82-Q84 WeakPolarHBondContact OD1-CB 3.31Å; D82-Q84 PolarHBondContact OD1-N 3.01Å; D82-G85 PolarHBondContact O-N 3.47Å
83	P	98.3	Very high	96.9	Very high	27 Å²	27	71.2 Å²	71.2	18%	0.175	40%	0.403	C	S	.	.	H	α-helix	trans	-61	-17.6	-176.7	25.6	-34.1	0	0	0	112.8	V61 K66 F81 G85 G86 L87	V61-P83 HydrophobicContact CG1-CB 3.73Å; V61-P83 HydrophobicContact CG2-CB 4.34Å; K66-P83 WeakPolarHBondContact O-CB 3.45Å; K66-P83 WeakPolarHBondContact O-CG 3.31Å; F81-P83 WeakPolarHBondContact O-CD 3.5Å; P83-G85 PolarHBondContact O-N 2.98Å; P83-G86 PolarHBondContact O-N 3.46Å; P83-L87 PolarHBondContact O-N 2.88Å; P83-L87 VanDerWaalsContact O-N 3.15Å
84	Q	98.4	Very high	97.2	Very high	86 Å²	86	71.5 Å²	71.5	40%	0.402	40%	0.395	S	S	.	.	H	α-helix	trans	-63.8	-24.8	174.8	-158.7	58.4	24.2	0	0	113	D82 K88	D82-Q84 PolarHBondContact O-N 3.48Å; D82-Q84 WeakPolarHBondContact OD1-CB 3.31Å; D82-Q84 PolarHBondContact OD1-N 3.01Å; Q84-K88 WeakPolarHBondContact O-CG 3.46Å; Q84-K88 PolarHBondContact O-N 2.86Å; Q84-K88 VanDerWaalsContact O-N 3.16Å
85	G	97.7	Very high	97.4	Very high	24 Å²	24	72.2 Å²	72.2	25%	0.247	40%	0.398	C	S	.	.	H	α-helix	trans	-61.6	-46.2	169.7	0	0	0	0	0	112.1	D82 P83 K88 N89	D82-G85 PolarHBondContact O-N 3.47Å; P83-G85 PolarHBondContact O-N 2.98Å; G85-K88 PolarHBondContact O-N 3.42Å; G85-N89 PolarHBondContact O-N 2.89Å; G85-N89 PolarHBondContact O-ND2 3.36Å
86	G	98.2	Very high	97.6	Very high	0 Å²	0	72.5 Å²	72.5	0%	0	40%	0.403	C	S	.	.	H	α-helix	trans	-62	-47.8	176.5	0	0	0	0	0	112.1	P83 K88 N89 I90	P83-G86 PolarHBondContact O-N 3.46Å; G86-K88 VanDerWaalsContact C-N 3.33Å; G86-K88 PolarHBondContact O-N 2.97Å; G86-N89 PolarHBondContact O-N 2.86Å; G86-N89 VanDerWaalsContact O-N 3.11Å; G86-I90 WeakPolarHBondContact O-CG1 3.49Å; G86-I90 PolarHBondContact O-N 2.92Å
87	L	98.6	Very high	97.9	Very high	34 Å²	34	73 Å²	73	18%	0.178	40%	0.397	C	S	.	.	H	α-helix	trans	-58.5	-40.2	179.2	-65.9	173.8	0	0	0	113.3	L63 K66 P83 I90 A91	L63-L87 HydrophobicContact CB-CD2 4.31Å; L63-L87 HydrophobicContact CD2-CD2 3.92Å; K66-L87 HydrophobicContact CB-CD1 4.09Å; K66-L87 HydrophobicContact CD-CD1 4.03Å; K66-L87 HydrophobicContact CG-CD1 3.92Å; P83-L87 PolarHBondContact O-N 2.88Å; P83-L87 VanDerWaalsContact O-N 3.15Å; L87-I90 PolarHBondContact O-N 3.46Å; L87-A91 PolarHBondContact O-N 3Å
88	K	98.5	Very high	98.1	Very high	137 Å²	137	67 Å²	67	60%	0.596	38%	0.379	S	S	*	.	H	α-helix	trans	-65.6	-40.8	176.3	-74.5	172.2	-177.8	172	0	112.2	Q84 G85 G86 A91 T92	Q84-K88 WeakPolarHBondContact O-CG 3.46Å; Q84-K88 PolarHBondContact O-N 2.86Å; Q84-K88 VanDerWaalsContact O-N 3.16Å; G85-K88 PolarHBondContact O-N 3.42Å; G86-K88 VanDerWaalsContact C-N 3.33Å; G86-K88 PolarHBondContact O-N 2.97Å; K88-A91 PolarHBondContact O-N 3.03Å; K88-T92 PolarHBondContact O-N 3.13Å; K88-T92 VanDerWaalsContact O-N 3.08Å; K88-T92 PolarHBondContact O-OG1 3.3Å
89	N	98.6	Very high	98.2	Very high	69 Å²	69	63.1 Å²	63.1	37%	0.369	36%	0.359	S	S	.	.	H	α-helix	trans	-66.3	-42.2	177.1	-77.4	-61.2	0	0	0	111.3	Y49 G85 G86 A91 T92 G93	Y49-N89 HydrophobicContact CD2-CB 4.09Å; Y49-N89 HydrophobicContact CE2-CB 3.89Å; G85-N89 PolarHBondContact O-N 2.89Å; G85-N89 PolarHBondContact O-ND2 3.36Å; G86-N89 PolarHBondContact O-N 2.86Å; G86-N89 VanDerWaalsContact O-N 3.11Å; N89-A91 PolarHBondContact O-N 3.43Å; N89-T92 CarbonylContact O-C 3.57Å; N89-T92 WeakPolarHBondContact O-CB 3.44Å; N89-T92 PolarHBondContact O-N 2.86Å; N89-T92 VanDerWaalsContact O-N 3.14Å; N89-G93 PolarHBondContact O-N 3.46Å
90	I	98.6	Very high	98.3	Very high	16 Å²	16	64.4 Å²	64.4	8%	0.082	36%	0.363	C	S	.	.	H	α-helix	trans	-60.7	-44.1	174.5	-70.4	-60	0	0	0	112.1	Y40 Q48 L63 G86 L87 T92 G93 K94	Y40-I90 HydrophobicContact CD2-CG2 3.8Å; Y40-I90 HydrophobicContact CE2-CG2 3.81Å; Q48-I90 WeakPolarHBondContact O-CD1 3.45Å; L63-I90 HydrophobicContact CD1-CD1 4.22Å; L63-I90 HydrophobicContact CD1-CG1 3.93Å; L63-I90 HydrophobicContact CD1-CG2 4.23Å; L63-I90 HydrophobicContact CD2-CG1 3.8Å; G86-I90 WeakPolarHBondContact O-CG1 3.49Å; G86-I90 PolarHBondContact O-N 2.92Å; L87-I90 PolarHBondContact O-N 3.46Å; I90-T92 VanDerWaalsContact C-N 3.26Å; I90-T92 PolarHBondContact O-N 3.39Å; I90-G93 WeakPolarHBondContact O-CA 3.31Å; I90-G93 PolarHBondContact O-N 3.13Å; I90-G93 VanDerWaalsContact O-N 3.13Å; I90-K94 PolarHBondContact O-N 2.92Å
91	A	98.4	Very high	98.4	Very high	61 Å²	61	61.3 Å²	61.3	50%	0.504	34%	0.339	S	S	.	.	H	α-helix	trans	-60.7	-37.7	175.3	0	0	0	0	0	112.3	L87 K88 N89 H95	L87-A91 PolarHBondContact O-N 3Å; K88-A91 PolarHBondContact O-N 3.03Å; N89-A91 PolarHBondContact O-N 3.43Å; A91-H95 PolarHBondContact O-N 3.01Å; A91-H95 VanDerWaalsContact O-N 3.16Å
92	T	98.6	Very high	98.4	Very high	73 Å²	73	65.8 Å²	65.8	45%	0.448	36%	0.359	S	S	.	.	H	α-helix	trans	-67	-42.6	173.9	-55.7	0	0	0	0	111.1	K88 N89 I90 K94 H95 N96	K88-T92 PolarHBondContact O-N 3.13Å; K88-T92 VanDerWaalsContact O-N 3.08Å; K88-T92 PolarHBondContact O-OG1 3.3Å; N89-T92 CarbonylContact O-C 3.57Å; N89-T92 WeakPolarHBondContact O-CB 3.44Å; N89-T92 PolarHBondContact O-N 2.86Å; N89-T92 VanDerWaalsContact O-N 3.14Å; I90-T92 VanDerWaalsContact C-N 3.26Å; I90-T92 PolarHBondContact O-N 3.39Å; T92-K94 PolarHBondContact O-N 2.73Å; T92-H95 PolarHBondContact O-N 3.4Å; T92-N96 WeakPolarHBondContact O-CB 3.46Å; T92-N96 VanDerWaalsContact O-CG 3.3Å; T92-N96 PolarHBondContact O-N 2.85Å
93	G	98.4	Very high	98.4	Very high	22 Å²	22	69.1 Å²	69.1	23%	0.227	36%	0.363	C	S	.	.	H	α-helix	trans	-56.8	-47.4	174.1	0	0	0	0	0	112.2	N89 I90 H95 N96 L97	N89-G93 PolarHBondContact O-N 3.46Å; I90-G93 WeakPolarHBondContact O-CA 3.31Å; I90-G93 PolarHBondContact O-N 3.13Å; I90-G93 VanDerWaalsContact O-N 3.13Å; G93-H95 PolarHBondContact O-N 2.62Å; G93-N96 PolarHBondContact O-N 2.81Å; G93-L97 WeakPolarHBondContact O-CB 3.41Å; G93-L97 PolarHBondContact O-N 3.45Å
94	K	98.6	Very high	98.5	Very high	95 Å²	95	70.2 Å²	70.2	41%	0.413	37%	0.371	S	S	.	.	H	α-helix	trans	-56	-48.8	174.2	-176.3	175.8	-161.5	150.1	0	112.5	Y40 D45 I90 T92 G98	Y40-K94 HydrophobicContact CD1-CB 3.95Å; Y40-K94 HydrophobicContact CD1-CG 4.32Å; Y40-K94 HydrophobicContact CD2-CB 4.3Å; Y40-K94 HydrophobicContact CE1-CB 3.59Å; Y40-K94 HydrophobicContact CE1-CD 4.18Å; Y40-K94 HydrophobicContact CE1-CG 3.54Å; Y40-K94 HydrophobicContact CE2-CB 3.93Å; Y40-K94 HydrophobicContact CE2-CG 4.43Å; Y40-K94 HydrophobicContact CG-CB 4.29Å; Y40-K94 WeakPolarHBondContact OH-CD 3.35Å; Y40-K94 VanDerWaalsContact OH-CE 3.28Å; Y40-K94 WeakPolarHBondContact OH-CE 3.45Å; Y40-K94 PolarHBondContact OH-NZ 2.68Å; D45-K94 VanDerWaalsContact OD1-CE 3.22Å; D45-K94 WeakPolarHBondContact OD1-CE 3.39Å; D45-K94 IonicContact OD1-NZ 3.78Å; D45-K94 PolarHBondContact OD1-NZ 2.93Å; D45-K94 IonicContact OD2-NZ 3.05Å; D45-K94 PolarHBondContact OD2-NZ 2.87Å; I90-K94 PolarHBondContact O-N 2.92Å; T92-K94 PolarHBondContact O-N 2.73Å; K94-G98 PolarHBondContact O-N 3.37Å
95	H	98.5	Very high	98.5	Very high	123 Å²	123	72.6 Å²	72.6	57%	0.569	39%	0.387	S	S	*	.	H	α-helix	trans	-61	-48.2	179.3	178.5	75.2	0	0	0	111.6	A91 T92 G93 G98 I99	A91-H95 PolarHBondContact O-N 3.01Å; A91-H95 VanDerWaalsContact O-N 3.16Å; T92-H95 PolarHBondContact O-N 3.4Å; G93-H95 PolarHBondContact O-N 2.62Å; H95-G98 PolarHBondContact O-N 3.28Å; H95-I99 WeakPolarHBondContact NE2-CD1 3.4Å; H95-I99 PolarHBondContact O-N 3.2Å
96	N	98.6	Very high	98.5	Very high	76 Å²	76	78.4 Å²	78.4	41%	0.406	41%	0.405	S	S	.	.	H	α-helix	trans	-65.3	-40.5	-179.2	-71.6	-13.4	0	0	0	112.1	T92 G93 G98 I99 L100	T92-N96 WeakPolarHBondContact O-CB 3.46Å; T92-N96 VanDerWaalsContact O-CG 3.3Å; T92-N96 PolarHBondContact O-N 2.85Å; G93-N96 PolarHBondContact O-N 2.81Å; N96-G98 VanDerWaalsContact C-N 3.32Å; N96-G98 PolarHBondContact O-N 3.4Å; N96-I99 PolarHBondContact O-N 3.38Å; N96-I99 VanDerWaalsContact O-N 3.12Å; N96-L100 WeakPolarHBondContact O-CG 3.31Å; N96-L100 PolarHBondContact O-N 2.99Å
97	L	98.6	Very high	98.5	Very high	44 Å²	44	83.2 Å²	83.2	23%	0.23	44%	0.435	C	S	.	.	H	α-helix	trans	-57.1	-47.3	175.2	-178.6	63.8	0	0	0	110.4	Y40 G93 I99 L100 T101	Y40-L97 HydrophobicContact CD1-CD2 3.76Å; Y40-L97 HydrophobicContact CE1-CD2 4.45Å; G93-L97 WeakPolarHBondContact O-CB 3.41Å; G93-L97 PolarHBondContact O-N 3.45Å; L97-I99 PolarHBondContact O-N 3.42Å; L97-L100 PolarHBondContact O-N 3.02Å; L97-L100 VanDerWaalsContact O-N 3.16Å; L97-T101 WeakPolarHBondContact O-CB 3.22Å; L97-T101 PolarHBondContact O-N 3.1Å; L97-T101 PolarHBondContact O-OG1 2.96Å
98	G	98.4	Very high	98.4	Very high	36 Å²	36	86.6 Å²	86.6	37%	0.371	46%	0.459	S	S	.	.	H	α-helix	trans	-59.2	-32.1	177.6	0	0	0	0	0	114.2	K94 H95 N96 K102	K94-G98 PolarHBondContact O-N 3.37Å; H95-G98 PolarHBondContact O-N 3.28Å; N96-G98 VanDerWaalsContact C-N 3.32Å; N96-G98 PolarHBondContact O-N 3.4Å; G98-K102 WeakPolarHBondContact O-CG 3.45Å
99	I	98.6	Very high	98.4	Very high	69 Å²	69	82.8 Å²	82.8	35%	0.354	45%	0.453	S	S	.	.	H	α-helix	trans	-74.9	-48.8	174.1	-66.8	172.6	0	0	0	110.8	H95 N96 L97 K102 R103	H95-I99 WeakPolarHBondContact NE2-CD1 3.4Å; H95-I99 PolarHBondContact O-N 3.2Å; N96-I99 PolarHBondContact O-N 3.38Å; N96-I99 VanDerWaalsContact O-N 3.12Å; L97-I99 PolarHBondContact O-N 3.42Å; I99-K102 PolarHBondContact O-N 3.43Å; I99-R103 WeakPolarHBondContact O-CB 3.19Å; I99-R103 PolarHBondContact O-N 3.1Å
100	L	98.5	Very high	98.4	Very high	93 Å²	93	84.6 Å²	84.6	49%	0.487	47%	0.466	S	S	.	.	H	α-helix	trans	-65.8	-40.4	-175.7	-72.8	177.1	0	0	0	112.2	N96 L97 K102 R103 S104	N96-L100 WeakPolarHBondContact O-CG 3.31Å; N96-L100 PolarHBondContact O-N 2.99Å; L97-L100 PolarHBondContact O-N 3.02Å; L97-L100 VanDerWaalsContact O-N 3.16Å; L100-K102 VanDerWaalsContact C-N 3.31Å; L100-K102 PolarHBondContact O-N 3.23Å; L100-R103 PolarHBondContact O-N 3.22Å; L100-S104 WeakPolarHBondContact O-CB 3.45Å; L100-S104 PolarHBondContact O-N 3.47Å; L100-S104 PolarHBondContact O-OG 3.36Å
101	T	98.4	Very high	98.4	Very high	40 Å²	40	87 Å²	87	25%	0.245	48%	0.479	C	S	.	.	H	α-helix	trans	-58.6	-42.1	174.7	-57.6	0	0	0	0	111.7	L97 S104 F106	L97-T101 WeakPolarHBondContact O-CB 3.22Å; L97-T101 PolarHBondContact O-N 3.1Å; L97-T101 PolarHBondContact O-OG1 2.96Å; T101-S104 PolarHBondContact O-OG 3.15Å; T101-F106 HydrophobicContact CG2-CD1 3.71Å; T101-F106 HydrophobicContact CG2-CE1 4.3Å; T101-F106 HydrophobicContact CG2-CG 4.43Å; T101-F106 WeakPolarHBondContact O-CA 2.94Å; T101-F106 PolarHBondContact O-N 3.4Å
102	K	98.5	Very high	98.4	Very high	144 Å²	144	88 Å²	88	63%	0.626	47%	0.474	S	S	*	.	H	α-helix	trans	-69.1	-42.3	176	-69.4	175.1	-175.6	176	0	111.5	G98 I99 L100 S104 N105 F106	G98-K102 WeakPolarHBondContact O-CG 3.45Å; I99-K102 PolarHBondContact O-N 3.43Å; L100-K102 VanDerWaalsContact C-N 3.31Å; L100-K102 PolarHBondContact O-N 3.23Å; K102-S104 VanDerWaalsContact C-N 3.29Å; K102-S104 PolarHBondContact O-N 3.37Å; K102-N105 PolarHBondContact O-N 3.01Å; K102-N105 VanDerWaalsContact O-N 3.13Å; K102-F106 HydrophobicContact CG-CE1 4.42Å; K102-F106 HydrophobicContact CG-CZ 4.14Å
103	R	98.6	Very high	98.3	Very high	183 Å²	183	86.7 Å²	86.7	69%	0.691	47%	0.47	S	S	*	.	H	α-helix	trans	-63.2	-35	179.9	-174.5	-177.6	-65.6	170.4	0.1	112.3	I99 L100 N105	I99-R103 WeakPolarHBondContact O-CB 3.19Å; I99-R103 PolarHBondContact O-N 3.1Å; L100-R103 PolarHBondContact O-N 3.22Å; R103-N105 PolarHBondContact O-N 2.88Å
104	S	98.4	Very high	98.3	Very high	49 Å²	49	86 Å²	86	34%	0.343	46%	0.462	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.3	9.9	176.6	70.4	0	0	0	0	113.7	L100 T101 K102 F106 T107	L100-S104 WeakPolarHBondContact O-CB 3.45Å; L100-S104 PolarHBondContact O-N 3.47Å; L100-S104 PolarHBondContact O-OG 3.36Å; T101-S104 PolarHBondContact O-OG 3.15Å; K102-S104 VanDerWaalsContact C-N 3.29Å; K102-S104 PolarHBondContact O-N 3.37Å; S104-F106 PolarHBondContact O-N 2.99Å; S104-T107 PolarHBondContact O-N 2.99Å; S104-T107 PolarHBondContact O-OG1 3.38Å
105	N	98.4	Very high	98.3	Very high	137 Å²	137	87.8 Å²	87.8	73%	0.733	47%	0.471	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.6	41.3	-172.4	-63.8	-37.8	0	0	0	113	K102 R103 T107	K102-N105 PolarHBondContact O-N 3.01Å; K102-N105 VanDerWaalsContact O-N 3.13Å; R103-N105 PolarHBondContact O-N 2.88Å; N105-T107 VanDerWaalsContact C-N 3.27Å; N105-T107 PolarHBondContact O-N 3.01Å
106	F	97.9	Very high	98.3	Very high	145 Å²	145	82 Å²	82	64%	0.636	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.1	29.9	178.4	-51.8	-92.5	0	0	0	114	T101 K102 S104 P108	T101-F106 HydrophobicContact CG2-CD1 3.71Å; T101-F106 HydrophobicContact CG2-CE1 4.3Å; T101-F106 HydrophobicContact CG2-CG 4.43Å; T101-F106 WeakPolarHBondContact O-CA 2.94Å; T101-F106 PolarHBondContact O-N 3.4Å; K102-F106 HydrophobicContact CG-CE1 4.42Å; K102-F106 HydrophobicContact CG-CZ 4.14Å; S104-F106 PolarHBondContact O-N 2.99Å; F106-P108 WeakPolarHBondContact O-CD 3.43Å
107	T	98.4	Very high	98.3	Very high	101 Å²	101	82.1 Å²	82.1	62%	0.62	45%	0.449	S	S	*	.	P	Polyproline II helix	trans	-62.7	120.5	172.5	-58.7	0	0	0	0	109.5	S104 N105	S104-T107 PolarHBondContact O-N 2.99Å; S104-T107 PolarHBondContact O-OG1 3.38Å; N105-T107 VanDerWaalsContact C-N 3.27Å; N105-T107 PolarHBondContact O-N 3.01Å
108	P	97.8	Very high	98.3	Very high	106 Å²	106	81.1 Å²	81.1	69%	0.688	45%	0.445	S	S	*	.	P	Polyproline II helix	trans	-77.6	163.3	178.2	32.9	-35	0	0	0	111.7	F106	F106-P108 WeakPolarHBondContact O-CD 3.43Å
109	A	97.7	Very high	98.3	Very high	56 Å²	56	83.4 Å²	83.4	46%	0.463	44%	0.444	S	S	.	.	P	Polyproline II helix	trans	-65.3	138.8	167.6	0	0	0	0	0	110.3	F140	A109-F140 HydrophobicContact CB-CE1 3.76Å; A109-F140 HydrophobicContact CB-CZ 4.12Å
110	T	98.3	Very high	98.3	Very high	107 Å²	107	82 Å²	82	66%	0.656	44%	0.439	S	S	*	.	P	Polyproline II helix	trans	-81.6	132.5	168.1	-57.1	0	0	0	0	108.2	F140	T110-F140 WeakPolarHBondContact O-CD1 3.47Å; T110-F140 WeakPolarHBondContact O-CE1 3.29Å
111	N	98.4	Very high	98.2	Very high	66 Å²	66	84.7 Å²	84.7	35%	0.353	45%	0.447	S	S	.	.	P	Polyproline II helix	trans	-78.7	140.5	179	-59	-27.2	0	0	0	110.9	F140 P141 W195	N111-F140 CarbonylContact C-O 3.49Å; N111-F140 WeakPolarHBondContact CA-O 3.46Å; N111-P141 VanDerWaalsContact OD1-CD 3.28Å; N111-P141 WeakPolarHBondContact OD1-CD 3.47Å; N111-W195 WeakPolarHBondContact ND2-CB 3.16Å; N111-W195 PolarHBondContact ND2-O 2.89Å
112	E	98.2	Very high	98.1	Very high	84 Å²	84	85.4 Å²	85.4	39%	0.393	45%	0.454	S	S	.	.	P	Polyproline II helix	trans	-102.8	153.5	168.8	-65.2	-59.5	151.1	0	0	111	P114 F140 H194 G196	E112-P114 WeakPolarHBondContact O-CD 3.39Å; E112-F140 HydrophobicContact CB-CB 4.08Å; E112-F140 HydrophobicContact CG-CB 3.98Å; E112-F140 PolarHBondContact N-O 3.12Å; E112-H194 PolarHBondContact O-CE1 3.01Å; E112-H194 PolarHBondContact O-ND1 3.3Å; E112-G196 WeakPolarHBondContact O-CA 3.37Å
113	A	98.3	Very high	97.9	Very high	45 Å²	45	84.1 Å²	84.1	37%	0.372	46%	0.461	S	S	.	.			trans	-89.1	114	175.3	0	0	0	0	0	109.8	N138 L197	A113-N138 PolarHBondContact O-ND2 2.82Å; A113-L197 HydrophobicContact CB-CD2 4.04Å
114	P	98.4	Very high	97.7	Very high	8 Å²	8	77.7 Å²	77.7	5%	0.052	44%	0.441	C	S	.	.			trans	-72.2	153	-180	30.1	-36.9	0	0	0	111.9	E112 V136 D137 N138 I139 I144 V192 H194 L197	E112-P114 WeakPolarHBondContact O-CD 3.39Å; P114-V136 HydrophobicContact CB-CG1 3.76Å; P114-D137 CarbonylContact C-O 3.56Å; P114-D137 WeakPolarHBondContact CA-O 3.15Å; P114-D137 WeakPolarHBondContact CB-O 3.47Å; P114-N138 WeakPolarHBondContact CA-O 3.37Å; P114-I139 HydrophobicContact CB-CG1 3.99Å; P114-I144 HydrophobicContact CB-CD1 4.39Å; P114-I144 HydrophobicContact CG-CD1 4.31Å; P114-V192 HydrophobicContact CG-CG1 4.27Å; P114-H194 WeakPolarHBondContact CD-ND1 3.21Å; P114-H194 HydrophobicContact CG-CB 3.59Å; P114-L197 HydrophobicContact CG-CD1 4.02Å; P114-L197 HydrophobicContact CG-CG 4.24Å
115	Q	98.2	Very high	97.4	Very high	131 Å²	131	79.7 Å²	79.7	61%	0.612	45%	0.448	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-115.3	121.9	179.5	-62.6	-177.9	46.4	0	0	109.9	V136 D137	Q115-V136 WeakPolarHBondContact O-CA 3.21Å; Q115-D137 PolarHBondContact N-O 3.48Å; Q115-D137 PolarHBondContact O-N 2.95Å
116	A	98.4	Very high	97.2	Very high	3 Å²	3	77.4 Å²	77.4	3%	0.025	44%	0.435	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	141	-179	0	0	0	0	0	112.1	F135 V136 V192 K203	A116-F135 CarbonylContact C-O 3.6Å; A116-F135 WeakPolarHBondContact CA-O 3.35Å; A116-V136 HydrophobicContact CB-CG2 4.12Å; A116-V192 HydrophobicContact CB-CG2 3.88Å; A116-K203 HydrophobicContact CB-CD 4.44Å; A116-K203 HydrophobicContact CB-CG 3.55Å; A116-K203 WeakPolarHBondContact O-CD 3.23Å; A116-K203 WeakPolarHBondContact O-CE 3.26Å; A116-K203 WeakPolarHBondContact O-CG 3.32Å; A116-K203 PolarHBondContact O-NZ 3.41Å
117	T	98.5	Very high	96.8	Very high	78 Å²	78	73 Å²	73	48%	0.479	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	134.9	173.9	-54.4	0	0	0	0	109.1	F119 C134 F135	T117-F119 HydrophobicContact CG2-CD1 4.15Å; T117-C134 WeakPolarHBondContact O-CA 3.36Å; T117-F135 PolarHBondContact N-O 2.73Å; T117-F135 PolarHBondContact O-N 2.86Å
118	V	98.6	Very high	96.7	Very high	23 Å²	23	73.6 Å²	73.6	14%	0.139	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	131.2	178.9	178.9	0	0	0	0	109.9	L132 I133 C134 W148 C190 K203 W205	V118-L132 HydrophobicContact CG1-CD2 4.35Å; V118-I133 VanDerWaalsContact CA-O 3.29Å; V118-I133 WeakPolarHBondContact CA-O 3.15Å; V118-C134 HydrophobicContact CG2-CB 4.18Å; V118-W148 HydrophobicContact CG1-CH2 4.1Å; V118-W148 HydrophobicContact CG1-CZ3 4.19Å; V118-C190 HydrophobicContact CG2-CB 3.46Å; V118-C190 VanDerWaalsContact CG2-CB 3.46Å; V118-K203 HydrophobicContact CB-CB 4.46Å; V118-K203 HydrophobicContact CG2-CB 3.55Å; V118-W205 HydrophobicContact CB-CB 4.32Å; V118-W205 HydrophobicContact CG1-CB 3.62Å; V118-W205 HydrophobicContact CG1-CG 3.93Å
119	F	97.9	Very high	96.7	Very high	84 Å²	84	73.9 Å²	73.9	37%	0.368	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153	152.2	178.2	54.8	-85.6	0	0	0	111.4	T117 I133 F135	T117-F119 HydrophobicContact CG2-CD1 4.15Å; F119-I133 HydrophobicContact CD2-CB 4.27Å; F119-I133 HydrophobicContact CD2-CD1 4.41Å; F119-I133 HydrophobicContact CE1-CB 4.48Å; F119-I133 HydrophobicContact CE1-CG2 4.34Å; F119-I133 HydrophobicContact CE2-CB 3.94Å; F119-I133 HydrophobicContact CE2-CD1 3.83Å; F119-I133 HydrophobicContact CE2-CG1 4.37Å; F119-I133 HydrophobicContact CE2-CG2 4.15Å; F119-I133 HydrophobicContact CZ-CB 4.05Å; F119-I133 HydrophobicContact CZ-CG2 3.83Å; F119-I133 PolarHBondContact N-O 2.81Å; F119-I133 PolarHBondContact O-N 2.85Å; F119-F135 HydrophobicContact CE1-CB 3.85Å; F119-F135 HydrophobicContact CZ-CB 4.39Å
120	P	97.8	Very high	96.7	Very high	38 Å²	38	71.8 Å²	71.8	25%	0.247	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	147.5	175.3	33.5	-35.1	0	0	0	110.9	S122 V124 L132 W205	P120-S122 VanDerWaalsContact C-N 3.26Å; P120-S122 PolarHBondContact O-N 3.21Å; P120-V124 HydrophobicContact CB-CG2 3.78Å; P120-V124 HydrophobicContact CG-CG2 3.82Å; P120-L132 HydrophobicContact CB-CD2 4.25Å; P120-W205 HydrophobicContact CB-CZ2 4.46Å; P120-W205 HydrophobicContact CG-CZ2 4.43Å
121	K	97.4	Very high	96.7	Very high	150 Å²	150	68 Å²	68	65%	0.652	39%	0.387	S	S	*	.	S	Bend	trans	-62	-33.7	176.7	-179.6	177.4	175.1	67.3	0	112.7	T131 I133	K121-T131 WeakPolarHBondContact CB-O 3.07Å; K121-T131 PolarHBondContact N-O 2.95Å; K121-I133 HydrophobicContact CB-CD1 4.04Å; K121-I133 HydrophobicContact CB-CG1 4.48Å; K121-I133 HydrophobicContact CG-CD1 4.45Å
122	S	96	Very high	96.7	Very high	55 Å²	55	64.9 Å²	64.9	39%	0.385	37%	0.37	S	S	.	.	S	Bend	trans	-141.6	162.9	-179.3	51.1	0	0	0	0	110.9	P120 V124 N130	P120-S122 VanDerWaalsContact C-N 3.26Å; P120-S122 PolarHBondContact O-N 3.21Å; S122-V124 PolarHBondContact O-N 2.99Å; S122-N130 PolarHBondContact N-OD1 2.87Å; S122-N130 PolarHBondContact O-ND2 2.9Å; S122-N130 PolarHBondContact OG-ND2 2.9Å; S122-N130 PolarHBondContact OG-OD1 3.21Å
123	P	94.8	Very high	96.7	Very high	118 Å²	118	61.7 Å²	61.7	77%	0.766	36%	0.355	S	S	*	.			trans	-48.8	136.9	174.2	-28	35.8	0	0	0	112
124	V	94.5	Very high	96.7	Very high	47 Å²	47	59.5 Å²	59.5	29%	0.285	34%	0.337	S	S	.	.			trans	-83.4	125.3	-171.6	-179.8	0	0	0	0	110.7	P120 S122 P182 W205 P207	P120-V124 HydrophobicContact CB-CG2 3.78Å; P120-V124 HydrophobicContact CG-CG2 3.82Å; S122-V124 PolarHBondContact O-N 2.99Å; V124-P182 HydrophobicContact CG1-CB 3.54Å; V124-P182 HydrophobicContact CG1-CG 3.72Å; V124-W205 HydrophobicContact CG1-CH2 4.41Å; V124-W205 HydrophobicContact CG2-CH2 4.08Å; V124-W205 HydrophobicContact CG2-CZ2 3.8Å; V124-P207 HydrophobicContact CG1-CB 4.27Å
125	L	92.6	Very high	96.7	Very high	91 Å²	91	61.8 Å²	61.8	48%	0.476	35%	0.346	S	S	.	.			trans	-125.6	124.4	173.6	-62	175.9	0	0	0	108.2	G127 Q128	L125-G127 PolarHBondContact O-N 2.98Å; L125-Q128 HydrophobicContact CB-CB 4.13Å; L125-Q128 HydrophobicContact CB-CG 4.01Å; L125-Q128 PolarHBondContact O-N 3.09Å; L125-Q128 VanDerWaalsContact O-N 3.13Å
126	L	92.3	Very high	96.8	Very high	89 Å²	89	55.5 Å²	55.5	47%	0.466	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57	136.3	-179.4	-63	179.6	0	0	0	110.9	Q128 P182 I209	L126-Q128 PolarHBondContact O-N 3.28Å; L126-P182 HydrophobicContact CD2-CB 4.3Å; L126-I209 HydrophobicContact CD1-CD1 4.37Å
127	G	91.1	Very high	96.8	Very high	54 Å²	54	57.9 Å²	57.9	56%	0.557	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.9	-3.9	-179.1	0	0	0	0	0	115.9	L125 P182	L125-G127 PolarHBondContact O-N 2.98Å; G127-P182 PolarHBondContact N-O 2.85Å; G127-P182 VanDerWaalsContact N-O 3.13Å
128	Q	95.1	Very high	96.8	Very high	113 Å²	113	55.8 Å²	55.8	53%	0.528	32%	0.315	S	S	.	.	S	Bend	trans	-99.7	130.7	175.3	-61.3	-167.9	21.3	0	0	111.3	L125 L126 N130 P182	L125-Q128 HydrophobicContact CB-CB 4.13Å; L125-Q128 HydrophobicContact CB-CG 4.01Å; L125-Q128 PolarHBondContact O-N 3.09Å; L125-Q128 VanDerWaalsContact O-N 3.13Å; L126-Q128 PolarHBondContact O-N 3.28Å; Q128-N130 PolarHBondContact O-N 2.9Å; Q128-P182 WeakPolarHBondContact O-CD 3.36Å
129	P	97.9	Very high	96.8	Very high	112 Å²	112	54.7 Å²	54.7	73%	0.727	31%	0.309	S	S	*	.			trans	-54	138.2	178.7	-26.2	34.5	0	0	0	113.1
130	N	97.5	Very high	96.8	Very high	11 Å²	11	53.9 Å²	53.9	6%	0.059	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	179.4	177.3	-157.6	-26.8	0	0	0	109.7	S122 Q128 T179 F180 P182	S122-N130 PolarHBondContact N-OD1 2.87Å; S122-N130 PolarHBondContact O-ND2 2.9Å; S122-N130 PolarHBondContact OG-ND2 2.9Å; S122-N130 PolarHBondContact OG-OD1 3.21Å; Q128-N130 PolarHBondContact O-N 2.9Å; N130-T179 WeakPolarHBondContact O-CA 3.44Å; N130-F180 HydrophobicContact CB-CD1 4.27Å; N130-F180 HydrophobicContact CB-CE1 3.65Å; N130-F180 HydrophobicContact CB-CZ 4.13Å; N130-F180 PolarHBondContact N-O 3.48Å; N130-F180 WeakPolarHBondContact O-CD1 3.23Å; N130-F180 PolarHBondContact O-N 2.85Å; N130-P182 HydrophobicContact CB-CG 4.2Å
131	T	98.3	Very high	96.8	Very high	29 Å²	29	52.7 Å²	52.7	18%	0.178	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	124.3	178.8	-53.2	0	0	0	0	109.2	K121 Y177 L178	K121-T131 WeakPolarHBondContact CB-O 3.07Å; K121-T131 PolarHBondContact N-O 2.95Å; T131-Y177 HydrophobicContact CG2-CD1 4.05Å; T131-Y177 HydrophobicContact CG2-CG 4.49Å; T131-L178 CarbonylContact C-O 3.55Å; T131-L178 VanDerWaalsContact CA-O 3.31Å; T131-L178 WeakPolarHBondContact CA-O 3.49Å
132	L	98.4	Very high	96.9	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	140.1	165.3	-71.4	174.8	0	0	0	109.4	V118 P120 W148 Y177 L178 F180 Y188 W205	V118-L132 HydrophobicContact CG1-CD2 4.35Å; P120-L132 HydrophobicContact CB-CD2 4.25Å; L132-W148 HydrophobicContact CB-CH2 3.57Å; L132-W148 HydrophobicContact CB-CZ2 4.33Å; L132-W148 HydrophobicContact CB-CZ3 3.86Å; L132-W148 HydrophobicContact CD1-CZ3 4.04Å; L132-Y177 CarbonylContact O-C 3.55Å; L132-Y177 VanDerWaalsContact O-CA 3.31Å; L132-Y177 WeakPolarHBondContact O-CA 3.4Å; L132-L178 HydrophobicContact CB-CB 4.49Å; L132-L178 PolarHBondContact N-O 3.48Å; L132-L178 PolarHBondContact O-N 3Å; L132-F180 HydrophobicContact CB-CE1 4.46Å; L132-F180 HydrophobicContact CD1-CE1 4.42Å; L132-F180 HydrophobicContact CD1-CZ 4.48Å; L132-F180 HydrophobicContact CD2-CE1 4.05Å; L132-F180 HydrophobicContact CD2-CZ 4.07Å; L132-F180 HydrophobicContact CG-CD1 3.97Å; L132-F180 HydrophobicContact CG-CE1 3.59Å; L132-F180 HydrophobicContact CG-CZ 3.92Å; L132-Y188 HydrophobicContact CD1-CD1 4.01Å; L132-Y188 HydrophobicContact CD1-CD2 4Å; L132-Y188 HydrophobicContact CD1-CG 3.59Å; L132-W205 HydrophobicContact CD1-CD2 4.08Å; L132-W205 HydrophobicContact CD1-CE3 3.61Å; L132-W205 HydrophobicContact CD1-CZ3 4.1Å; L132-W205 HydrophobicContact CD2-CD2 3.43Å; L132-W205 VanDerWaalsContact CD2-CD2 3.43Å; L132-W205 HydrophobicContact CD2-CE3 3.66Å; L132-W205 HydrophobicContact CD2-CG 3.92Å; L132-W205 HydrophobicContact CD2-CH2 4.12Å; L132-W205 HydrophobicContact CD2-CZ2 3.93Å; L132-W205 HydrophobicContact CD2-CZ3 3.99Å; L132-W205 HydrophobicContact CG-CD2 4.4Å; L132-W205 HydrophobicContact CG-CE3 4.22Å; L132-W205 HydrophobicContact CG-CZ3 4.48Å
133	I	98.8	Very high	96.9	Very high	16 Å²	16	45.1 Å²	45.1	8%	0.082	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	123.9	178.1	-53.2	-179.8	0	0	0	106.8	V118 F119 K121 L175 Y177	V118-I133 VanDerWaalsContact CA-O 3.29Å; V118-I133 WeakPolarHBondContact CA-O 3.15Å; F119-I133 HydrophobicContact CD2-CB 4.27Å; F119-I133 HydrophobicContact CD2-CD1 4.41Å; F119-I133 HydrophobicContact CE1-CB 4.48Å; F119-I133 HydrophobicContact CE1-CG2 4.34Å; F119-I133 HydrophobicContact CE2-CB 3.94Å; F119-I133 HydrophobicContact CE2-CD1 3.83Å; F119-I133 HydrophobicContact CE2-CG1 4.37Å; F119-I133 HydrophobicContact CE2-CG2 4.15Å; F119-I133 HydrophobicContact CZ-CB 4.05Å; F119-I133 HydrophobicContact CZ-CG2 3.83Å; F119-I133 PolarHBondContact N-O 2.81Å; F119-I133 PolarHBondContact O-N 2.85Å; K121-I133 HydrophobicContact CB-CD1 4.04Å; K121-I133 HydrophobicContact CB-CG1 4.48Å; K121-I133 HydrophobicContact CG-CD1 4.45Å; I133-L175 HydrophobicContact CG2-CD2 3.91Å; I133-Y177 HydrophobicContact CB-CD1 4.49Å; I133-Y177 HydrophobicContact CD1-CD1 4.35Å; I133-Y177 HydrophobicContact CD1-CE1 4.03Å; I133-Y177 HydrophobicContact CG1-CD1 3.82Å; I133-Y177 HydrophobicContact CG1-CE1 3.94Å; I133-Y177 HydrophobicContact CG2-CD1 4.34Å; I133-Y177 HydrophobicContact CG2-CE1 4.04Å
134	C	98.8	Very high	97.1	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	102.8	166.7	-172.9	0	0	0	0	107.9	T117 V118 W148 L175 S176 C190	T117-C134 WeakPolarHBondContact O-CA 3.36Å; V118-C134 HydrophobicContact CG2-CB 4.18Å; C134-W148 HydrophobicContact CB-CH2 3.71Å; C134-W148 HydrophobicContact CB-CZ2 3.5Å; C134-L175 WeakPolarHBondContact O-CA 3.45Å; C134-S176 PolarHBondContact N-O 2.97Å; C134-S176 PolarHBondContact O-N 3.23Å; C134-C190 HydrophobicContact CB-CB 3.63Å; C134-C190 WeakPolarHBondContact CB-SG 3.25Å; C134-C190 WeakPolarHBondContact SG-CB 3.5Å; C134-C190 CovalentContact SG-SG 2.03Å; C134-C190 PolarHBondContact SG-SG 2.89Å
135	F	98.8	Very high	97.3	Very high	55 Å²	55	42.2 Å²	42.2	24%	0.241	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87	121.2	172.6	173.8	-108.1	0	0	0	108.5	A116 T117 F119 D137 H173 L175	A116-F135 CarbonylContact C-O 3.6Å; A116-F135 WeakPolarHBondContact CA-O 3.35Å; T117-F135 PolarHBondContact N-O 2.73Å; T117-F135 PolarHBondContact O-N 2.86Å; F119-F135 HydrophobicContact CE1-CB 3.85Å; F119-F135 HydrophobicContact CZ-CB 4.39Å; F135-D137 HydrophobicContact CD1-CB 4.4Å; F135-D137 HydrophobicContact CE1-CB 3.57Å; F135-D137 HydrophobicContact CZ-CB 3.72Å; F135-H173 HydrophobicContact CE2-CB 3.85Å; F135-H173 AromaticContact CE2-CD2 3.76Å; F135-H173 AromaticContact CE2-CG 3.96Å; F135-H173 HydrophobicContact CZ-CB 4.12Å; F135-L175 HydrophobicContact CD2-CD1 4.28Å; F135-L175 HydrophobicContact CD2-CD2 4.35Å; F135-L175 HydrophobicContact CD2-CG 4.04Å
136	V	98.8	Very high	97.6	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	119.1	178.3	-169.3	0	0	0	0	108.7	P114 Q115 A116 I139 I144 I146 H173 K174 V192	P114-V136 HydrophobicContact CB-CG1 3.76Å; Q115-V136 WeakPolarHBondContact O-CA 3.21Å; A116-V136 HydrophobicContact CB-CG2 4.12Å; V136-I139 HydrophobicContact CB-CD1 4.16Å; V136-I139 HydrophobicContact CG1-CD1 4Å; V136-I139 HydrophobicContact CG1-CG1 3.98Å; V136-I139 WeakPolarHBondContact O-CD1 3.34Å; V136-I144 HydrophobicContact CB-CD1 4.42Å; V136-I144 HydrophobicContact CG1-CD1 3.6Å; V136-I146 HydrophobicContact CB-CD1 4.39Å; V136-I146 HydrophobicContact CG2-CD1 3.78Å; V136-I146 HydrophobicContact CG2-CG1 4.34Å; V136-H173 CarbonylContact O-C 3.49Å; V136-H173 WeakPolarHBondContact O-CA 3.4Å; V136-H173 WeakPolarHBondContact O-CB 3.16Å; V136-K174 PolarHBondContact N-O 2.03Å; V136-K174 PolarHBondContact O-N 2.98Å; V136-V192 HydrophobicContact CG1-CG1 4.1Å; V136-V192 HydrophobicContact CG2-CG2 3.87Å
137	D	98.5	Very high	97.9	Very high	53 Å²	53	35.6 Å²	35.6	28%	0.283	20%	0.204	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	172.5	-175.8	-160.5	6.1	0	0	0	111.4	P114 Q115 F135 I139 N167 H173	P114-D137 CarbonylContact C-O 3.56Å; P114-D137 WeakPolarHBondContact CA-O 3.15Å; P114-D137 WeakPolarHBondContact CB-O 3.47Å; Q115-D137 PolarHBondContact N-O 3.48Å; Q115-D137 PolarHBondContact O-N 2.95Å; F135-D137 HydrophobicContact CD1-CB 4.4Å; F135-D137 HydrophobicContact CE1-CB 3.57Å; F135-D137 HydrophobicContact CZ-CB 3.72Å; D137-I139 VanDerWaalsContact C-N 3.25Å; D137-I139 PolarHBondContact O-N 2.84Å; D137-N167 PolarHBondContact OD1-ND2 2.77Å; D137-H173 HydrophobicContact CB-CB 4.39Å
138	N	98.3	Very high	98.2	Very high	34 Å²	34	33.1 Å²	33.1	18%	0.182	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	55.7	39.4	-179.6	-166	51.3	0	0	0	112.6	A113 P114 F172	A113-N138 PolarHBondContact O-ND2 2.82Å; P114-N138 WeakPolarHBondContact CA-O 3.37Å; N138-F172 PolarHBondContact N-O 3Å
139	I	98.8	Very high	98.4	Very high	0 Å²	0	29 Å²	29	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	116.1	179.2	-51.5	169.9	0	0	0	108.2	P114 V136 D137 I144 F164 F172 K174	P114-I139 HydrophobicContact CB-CG1 3.99Å; V136-I139 HydrophobicContact CB-CD1 4.16Å; V136-I139 HydrophobicContact CG1-CD1 4Å; V136-I139 HydrophobicContact CG1-CG1 3.98Å; V136-I139 WeakPolarHBondContact O-CD1 3.34Å; D137-I139 VanDerWaalsContact C-N 3.25Å; D137-I139 PolarHBondContact O-N 2.84Å; I139-I144 HydrophobicContact CD1-CD1 3.83Å; I139-I144 HydrophobicContact CG1-CD1 3.97Å; I139-I144 HydrophobicContact CG2-CB 4.5Å; I139-I144 HydrophobicContact CG2-CD1 4.28Å; I139-F164 HydrophobicContact CD1-CD1 4.3Å; I139-F164 HydrophobicContact CD1-CE1 4.25Å; I139-F164 HydrophobicContact CG2-CD1 4.48Å; I139-F164 HydrophobicContact CG2-CE1 4.08Å; I139-F172 WeakPolarHBondContact CA-O 3.03Å; I139-F172 HydrophobicContact CB-CB 4.18Å; I139-F172 VanDerWaalsContact CB-O 3.23Å; I139-F172 WeakPolarHBondContact CB-O 3.21Å; I139-F172 WeakPolarHBondContact CG1-O 3.44Å; I139-F172 PolarHBondContact N-O 3.05Å; I139-F172 WeakPolarHBondContact O-CD2 3.4Å; I139-F172 PolarHBondContact O-N 3.15Å; I139-K174 HydrophobicContact CD1-CB 3.79Å
140	F	98.5	Very high	98.4	Very high	67 Å²	67	29 Å²	29	29%	0.294	15%	0.145	S	C	.	.			trans	-155.2	126.6	168.8	-172.1	-95.9	0	0	0	111.3	A109 T110 N111 E112 F172 H194	A109-F140 HydrophobicContact CB-CE1 3.76Å; A109-F140 HydrophobicContact CB-CZ 4.12Å; T110-F140 WeakPolarHBondContact O-CD1 3.47Å; T110-F140 WeakPolarHBondContact O-CE1 3.29Å; N111-F140 CarbonylContact C-O 3.49Å; N111-F140 WeakPolarHBondContact CA-O 3.46Å; E112-F140 HydrophobicContact CB-CB 4.08Å; E112-F140 HydrophobicContact CG-CB 3.98Å; E112-F140 PolarHBondContact N-O 3.12Å; F140-F172 HydrophobicContact CD2-CD2 4.44Å; F140-F172 HydrophobicContact CD2-CE2 4.24Å; F140-H194 PolarHBondContact O-CE1 3.11Å
141	P	98.2	Very high	98.4	Very high	13 Å²	13	31.6 Å²	31.6	8%	0.084	16%	0.159	C	C	.	.	S	Bend	cis	-69.9	166.5	-2.5	30.5	-35.9	0	0	0	113.1	N111 V143 H194 W195	N111-P141 VanDerWaalsContact OD1-CD 3.28Å; N111-P141 WeakPolarHBondContact OD1-CD 3.47Å; P141-V143 PolarHBondContact O-N 3.25Å; P141-H194 PolarHBondContact O-NE2 2.74Å; P141-H194 VanDerWaalsContact O-NE2 3.1Å; P141-W195 HydrophobicContact CG-CE3 3.57Å; P141-W195 HydrophobicContact CG-CZ3 3.56Å
142	P	98.1	Very high	98.4	Very high	7 Å²	7	34.6 Å²	34.6	5%	0.045	18%	0.181	C	C	.	.	S	Bend	trans	-75.3	68.2	-178.6	29.5	-32.6	0	0	0	112	V39 F164 F172	V39-P142 HydrophobicContact CG1-CG 3.83Å; P142-F164 HydrophobicContact CB-CB 4.12Å; P142-F164 HydrophobicContact CB-CD1 3.79Å; P142-F164 HydrophobicContact CB-CD2 3.78Å; P142-F164 HydrophobicContact CB-CE1 4.09Å; P142-F164 HydrophobicContact CB-CE2 4.08Å; P142-F164 HydrophobicContact CB-CG 3.63Å; P142-F164 HydrophobicContact CB-CZ 4.22Å; P142-F164 WeakPolarHBondContact O-CE2 3.25Å; P142-F164 VanDerWaalsContact O-CZ 3.3Å; P142-F164 WeakPolarHBondContact O-CZ 3Å; P142-F172 HydrophobicContact CB-CB 4.5Å; P142-F172 HydrophobicContact CB-CD1 4.27Å; P142-F172 HydrophobicContact CB-CD2 3.69Å; P142-F172 HydrophobicContact CB-CE1 4.43Å; P142-F172 HydrophobicContact CB-CE2 3.91Å; P142-F172 HydrophobicContact CB-CG 3.89Å; P142-F172 HydrophobicContact CB-CZ 4.27Å; P142-F172 HydrophobicContact CG-CD2 3.9Å; P142-F172 HydrophobicContact CG-CE1 4.43Å; P142-F172 HydrophobicContact CG-CE2 3.58Å; P142-F172 HydrophobicContact CG-CG 4.47Å; P142-F172 HydrophobicContact CG-CZ 3.86Å
143	V	97.6	Very high	98.4	Very high	38 Å²	38	42.2 Å²	42.2	23%	0.23	21%	0.214	C	C	.	.			trans	-138.7	114.9	171.6	-176.9	0	0	0	0	107.6	P141 H194 W195	P141-V143 PolarHBondContact O-N 3.25Å; V143-H194 PolarHBondContact O-CD2 3.15Å; V143-W195 HydrophobicContact CB-CH2 4Å; V143-W195 HydrophobicContact CB-CZ2 4.21Å; V143-W195 HydrophobicContact CB-CZ3 4.29Å; V143-W195 HydrophobicContact CG1-CH2 4.08Å; V143-W195 HydrophobicContact CG1-CZ2 3.85Å; V143-W195 HydrophobicContact CG2-CH2 3.77Å; V143-W195 HydrophobicContact CG2-CZ2 4.39Å; V143-W195 HydrophobicContact CG2-CZ3 4.1Å
144	I	98.4	Very high	98.3	Very high	27 Å²	27	45.3 Å²	45.3	14%	0.138	24%	0.237	C	C	.	.			trans	-145.8	149.4	-176	-156.8	165.5	0	0	0	110.3	P114 V136 I139 I146 F164 K174 V192 E193 H194	P114-I144 HydrophobicContact CB-CD1 4.39Å; P114-I144 HydrophobicContact CG-CD1 4.31Å; V136-I144 HydrophobicContact CB-CD1 4.42Å; V136-I144 HydrophobicContact CG1-CD1 3.6Å; I139-I144 HydrophobicContact CD1-CD1 3.83Å; I139-I144 HydrophobicContact CG1-CD1 3.97Å; I139-I144 HydrophobicContact CG2-CB 4.5Å; I139-I144 HydrophobicContact CG2-CD1 4.28Å; I144-I146 HydrophobicContact CD1-CG1 4.38Å; I144-I146 HydrophobicContact CG1-CG1 4.28Å; I144-I146 HydrophobicContact CG2-CD1 4.11Å; I144-I146 HydrophobicContact CG2-CG1 4.09Å; I144-F164 HydrophobicContact CB-CE1 4.28Å; I144-F164 HydrophobicContact CB-CZ 4.42Å; I144-F164 HydrophobicContact CG2-CE1 3.64Å; I144-F164 HydrophobicContact CG2-CZ 3.79Å; I144-K174 HydrophobicContact CG2-CD 4.14Å; I144-V192 HydrophobicContact CD1-CG1 3.59Å; I144-V192 HydrophobicContact CG1-CG1 3.94Å; I144-E193 WeakPolarHBondContact CG1-O 3.43Å; I144-H194 HydrophobicContact CG1-CB 4.36Å
145	N	98.5	Very high	98.3	Very high	78 Å²	78	47 Å²	47	42%	0.417	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	118.2	166.9	-174.8	24.2	0	0	0	108.9	V192 E193	N145-V192 WeakPolarHBondContact O-CA 3.44Å; N145-E193 HydrophobicContact CB-CB 4.19Å; N145-E193 PolarHBondContact N-O 3.48Å; N145-E193 PolarHBondContact ND2-OE2 3.08Å; N145-E193 PolarHBondContact O-N 3.36Å
146	I	98.7	Very high	98.2	Very high	9 Å²	9	49.4 Å²	49.4	5%	0.046	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	128.7	176.5	-56.1	170.4	0	0	0	107	V136 I144 K174 K191 V192	V136-I146 HydrophobicContact CB-CD1 4.39Å; V136-I146 HydrophobicContact CG2-CD1 3.78Å; V136-I146 HydrophobicContact CG2-CG1 4.34Å; I144-I146 HydrophobicContact CD1-CG1 4.38Å; I144-I146 HydrophobicContact CG1-CG1 4.28Å; I144-I146 HydrophobicContact CG2-CD1 4.11Å; I144-I146 HydrophobicContact CG2-CG1 4.09Å; I146-K174 HydrophobicContact CD1-CD 4.29Å; I146-K174 HydrophobicContact CD1-CG 4.3Å; I146-K191 CarbonylContact C-O 3.56Å; I146-K191 WeakPolarHBondContact CA-O 3.44Å; I146-V192 HydrophobicContact CG1-CG2 4.47Å
147	T	98.6	Very high	98.2	Very high	32 Å²	32	55.9 Å²	55.9	20%	0.196	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	132.4	-179.5	-53.7	0	0	0	0	109.8	L149 S154 K191	T147-L149 HydrophobicContact CG2-CD2 4.3Å; T147-S154 WeakPolarHBondContact CG2-OG 3.22Å; T147-K191 PolarHBondContact N-O 2.93Å; T147-K191 WeakPolarHBondContact O-CB 3.43Å; T147-K191 PolarHBondContact O-N 2.93Å
148	W	98.8	Very high	98.1	Very high	2 Å²	2	55.2 Å²	55.2	1%	0.008	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	134.9	171.8	-72.3	98.5	0	0	0	111	V118 L132 C134 S154 V155 V159 S176 L178 C190	V118-W148 HydrophobicContact CG1-CH2 4.1Å; V118-W148 HydrophobicContact CG1-CZ3 4.19Å; L132-W148 HydrophobicContact CB-CH2 3.57Å; L132-W148 HydrophobicContact CB-CZ2 4.33Å; L132-W148 HydrophobicContact CB-CZ3 3.86Å; L132-W148 HydrophobicContact CD1-CZ3 4.04Å; C134-W148 HydrophobicContact CB-CH2 3.71Å; C134-W148 HydrophobicContact CB-CZ2 3.5Å; W148-S154 WeakPolarHBondContact O-CA 3.49Å; W148-V155 HydrophobicContact CB-CG1 3.61Å; W148-V155 PolarHBondContact O-N 2.97Å; W148-V159 HydrophobicContact CB-CG2 4.42Å; W148-V159 HydrophobicContact CG-CG2 4.31Å; W148-S176 PolarHBondContact NE1-OG 2.91Å; W148-L178 HydrophobicContact CB-CD2 4.07Å; W148-L178 HydrophobicContact CD2-CB 3.64Å; W148-L178 HydrophobicContact CD2-CD2 3.9Å; W148-L178 HydrophobicContact CD2-CG 4.36Å; W148-L178 HydrophobicContact CE3-CB 4.13Å; W148-L178 HydrophobicContact CE3-CD2 3.82Å; W148-L178 HydrophobicContact CG-CB 3.89Å; W148-L178 HydrophobicContact CG-CD2 4.03Å; W148-L178 HydrophobicContact CG-CG 4.38Å; W148-L178 HydrophobicContact CZ2-CB 4.1Å; W148-C190 HydrophobicContact CE3-CB 4.37Å; W148-C190 HydrophobicContact CH2-CB 4.29Å; W148-C190 HydrophobicContact CZ3-CB 4.09Å
149	L	98.7	Very high	98.1	Very high	27 Å²	27	55.8 Å²	55.8	14%	0.141	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	135	170	-49.7	179.7	0	0	0	108.8	T147 K153 Y188 D189 K191 L202	T147-L149 HydrophobicContact CG2-CD2 4.3Å; L149-K153 CarbonylContact C-O 3.55Å; L149-K153 VanDerWaalsContact CA-O 3.26Å; L149-K153 WeakPolarHBondContact CA-O 3.43Å; L149-Y188 CarbonylContact O-C 3.58Å; L149-Y188 VanDerWaalsContact O-CA 3.25Å; L149-Y188 WeakPolarHBondContact O-CA 3.23Å; L149-D189 HydrophobicContact CB-CB 4.14Å; L149-D189 HydrophobicContact CD1-CB 4.28Å; L149-D189 HydrophobicContact CG-CB 4.47Å; L149-D189 PolarHBondContact N-O 2.91Å; L149-D189 PolarHBondContact O-N 2.79Å; L149-K191 HydrophobicContact CD1-CB 4.5Å; L149-L202 HydrophobicContact CD1-CD2 3.87Å
150	R	98.1	Very high	98	Very high	110 Å²	110	60.9 Å²	60.9	42%	0.415	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	121	165.7	178.5	179.7	172.4	-179.5	1.4	108	S152 K153 V155 D186 I187 Y188	R150-S152 PolarHBondContact O-N 2.77Å; R150-K153 PolarHBondContact N-O 3.04Å; R150-K153 PolarHBondContact O-N 2.89Å; R150-V155 HydrophobicContact CB-CG1 4.39Å; R150-D186 IonicContact CZ-OD1 3.23Å; R150-D186 IonicContact CZ-OD2 2.72Å; R150-D186 VanDerWaalsContact CZ-OD2 3.23Å; R150-D186 IonicContact NE-OD1 3.28Å; R150-D186 PolarHBondContact NE-OD1 2.96Å; R150-D186 IonicContact NE-OD2 2.69Å; R150-D186 PolarHBondContact NE-OD2 3.3Å; R150-D186 VanDerWaalsContact NH2-CG 3.28Å; R150-D186 IonicContact NH2-OD1 2.62Å; R150-D186 PolarHBondContact NH2-OD1 2.83Å; R150-D186 IonicContact NH2-OD2 3.81Å; R150-D186 PolarHBondContact NH2-OD2 3.06Å; R150-I187 WeakPolarHBondContact CA-O 3.31Å; R150-Y188 HydrophobicContact CB-CD1 4.09Å; R150-Y188 HydrophobicContact CB-CE1 3.96Å; R150-Y188 HydrophobicContact CG-CD1 4.25Å; R150-Y188 HydrophobicContact CG-CE1 3.76Å
151	N	97.4	Very high	97.9	Very high	67 Å²	67	60.6 Å²	60.6	36%	0.358	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.9	47.1	-174.6	-55.1	-35.7	0	0	0	111.6	K153 D186 I187	N151-K153 PolarHBondContact O-N 3.01Å; N151-K153 VanDerWaalsContact O-N 3.12Å; N151-D186 PolarHBondContact ND2-OD1 3.43Å; N151-I187 PolarHBondContact N-O 2.83Å; N151-I187 WeakPolarHBondContact OD1-CG1 3.24Å; N151-I187 PolarHBondContact OD1-N 2.87Å
152	S	97.3	Very high	97.9	Very high	91 Å²	91	60.5 Å²	60.5	64%	0.636	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.2	10.7	-177.5	-45.5	0	0	0	0	116.4	R150	R150-S152 PolarHBondContact O-N 2.77Å
153	K	98.1	Very high	97.9	Very high	161 Å²	161	60.9 Å²	60.9	70%	0.7	33%	0.333	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108.4	136.6	175.6	-65	178.2	-176.8	175.1	0	110.4	L149 R150 N151 V155	L149-K153 CarbonylContact C-O 3.55Å; L149-K153 VanDerWaalsContact CA-O 3.26Å; L149-K153 WeakPolarHBondContact CA-O 3.43Å; R150-K153 PolarHBondContact N-O 3.04Å; R150-K153 PolarHBondContact O-N 2.89Å; N151-K153 PolarHBondContact O-N 3.01Å; N151-K153 VanDerWaalsContact O-N 3.12Å; K153-V155 PolarHBondContact O-N 2.76Å
154	S	98	Very high	98	Very high	80 Å²	80	60.4 Å²	60.4	56%	0.559	33%	0.328	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-61.6	135.7	178.4	-178	0	0	0	0	111.6	T147 W148	T147-S154 WeakPolarHBondContact CG2-OG 3.22Å; W148-S154 WeakPolarHBondContact O-CA 3.49Å
155	V	97.7	Very high	97.9	Very high	35 Å²	35	59.4 Å²	59.4	21%	0.212	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	134.6	174.2	59.7	0	0	0	0	109.7	W148 R150 K153 L178	W148-V155 HydrophobicContact CB-CG1 3.61Å; W148-V155 PolarHBondContact O-N 2.97Å; R150-V155 HydrophobicContact CB-CG1 4.39Å; K153-V155 PolarHBondContact O-N 2.76Å; V155-L178 HydrophobicContact CG1-CD1 3.96Å; V155-L178 HydrophobicContact CG1-CD2 4.06Å; V155-L178 HydrophobicContact CG2-CD1 4.27Å
156	T	97.6	Very high	97.9	Very high	107 Å²	107	58.1 Å²	58.1	66%	0.656	32%	0.318	S	S	*	.			trans	-119.3	-20.3	177.5	54	0	0	0	0	112.3	G158 V159	T156-G158 PolarHBondContact O-N 2.97Å; T156-V159 WeakPolarHBondContact O-CB 3.46Å; T156-V159 PolarHBondContact O-N 2.8Å
157	D	97.8	Very high	97.7	Very high	135 Å²	135	59.1 Å²	59.1	72%	0.722	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.5	127.8	-179.6	-66.5	-18.5	0	0	0	110.1	V159	D157-V159 PolarHBondContact O-N 2.98Å
158	G	96.8	Very high	97.5	Very high	39 Å²	39	67 Å²	67	40%	0.402	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.7	15.5	-177.5	0	0	0	0	0	114.3	T156 T179	T156-G158 PolarHBondContact O-N 2.97Å; G158-T179 VanDerWaalsContact CA-OG1 3.31Å; G158-T179 WeakPolarHBondContact CA-OG1 3.35Å; G158-T179 PolarHBondContact O-N 2.86Å; G158-T179 PolarHBondContact O-OG1 2.78Å
159	V	98.3	Very high	97.3	Very high	47 Å²	47	71.8 Å²	71.8	29%	0.285	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	135.9	173	179.3	0	0	0	0	110.7	W148 T156 D157 Y177 L178	W148-V159 HydrophobicContact CB-CG2 4.42Å; W148-V159 HydrophobicContact CG-CG2 4.31Å; T156-V159 WeakPolarHBondContact O-CB 3.46Å; T156-V159 PolarHBondContact O-N 2.8Å; D157-V159 PolarHBondContact O-N 2.98Å; V159-Y177 VanDerWaalsContact CA-O 3.22Å; V159-Y177 WeakPolarHBondContact CA-O 3.41Å; V159-L178 HydrophobicContact CG2-CD1 3.75Å
160	Y	96.4	Very high	97.1	Very high	107 Å²	107	77.4 Å²	77.4	42%	0.42	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	151.7	173.4	172.4	-102.4	0	0	0	109.7	S176 Y177	Y160-S176 CarbonylContact O-C 3.55Å; Y160-S176 WeakPolarHBondContact O-CA 3.29Å; Y160-Y177 AromaticContact CD1-CD2 3.6Å; Y160-Y177 HydrophobicContact CD1-CD2 3.6Å; Y160-Y177 AromaticContact CD1-CE2 4Å; Y160-Y177 HydrophobicContact CD1-CE2 4Å; Y160-Y177 HydrophobicContact CD1-CG 4.44Å; Y160-Y177 HydrophobicContact CE1-CD2 4.28Å; Y160-Y177 HydrophobicContact CE1-CE2 4.23Å; Y160-Y177 PolarHBondContact N-O 3Å; Y160-Y177 VanDerWaalsContact N-O 3.09Å; Y160-Y177 WeakPolarHBondContact O-CD2 3.34Å; Y160-Y177 PolarHBondContact O-N 3.05Å
161	E	97.3	Very high	97.1	Very high	61 Å²	61	72.5 Å²	72.5	29%	0.285	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	149.8	-180	-55.6	-169.8	165.4	0	0	111.5	K174 L175 S176	E161-K174 WeakPolarHBondContact OE2-CE 3.47Å; E161-K174 IonicContact OE2-NZ 2.88Å; E161-K174 PolarHBondContact OE2-NZ 3.02Å; E161-L175 VanDerWaalsContact CA-O 3.29Å; E161-L175 WeakPolarHBondContact CA-O 3.17Å; E161-S176 PolarHBondContact OE1-OG 2.89Å
162	T	98.1	Very high	97.1	Very high	11 Å²	11	70.1 Å²	70.1	7%	0.067	37%	0.37	C	S	.	.	P	Polyproline II helix	trans	-78.8	170.6	170.5	64.1	0	0	0	0	111.8	E57 K174 L175 Y177	E57-T162 WeakPolarHBondContact OE2-CB 3.29Å; T162-K174 WeakPolarHBondContact O-CE 3.3Å; T162-L175 HydrophobicContact CG2-CB 3.99Å; T162-L175 HydrophobicContact CG2-CD1 4.31Å; T162-L175 PolarHBondContact N-O 2.88Å; T162-L175 PolarHBondContact OG1-N 2.86Å; T162-Y177 HydrophobicContact CG2-CE2 3.98Å
163	S	98.3	Very high	97.2	Very high	14 Å²	14	67.2 Å²	67.2	10%	0.098	35%	0.346	C	S	.	.	P	Polyproline II helix	trans	-64.7	173.8	158	-62.9	0	0	0	0	111.3	E57 Y60 L165	E57-S163 WeakPolarHBondContact OE1-CB 3.29Å; E57-S163 PolarHBondContact OE1-OG 2.95Å; E57-S163 PolarHBondContact OE2-N 3.3Å; Y60-S163 WeakPolarHBondContact CB-OG 3.23Å; S163-L165 PolarHBondContact O-N 2.8Å
164	F	98.6	Very high	97.2	Very high	28 Å²	28	60.8 Å²	60.8	12%	0.123	32%	0.318	C	S	.	.	P	Polyproline II helix	trans	-73.3	121.5	165.7	-65.9	-78.3	0	0	0	109.8	Q48 I139 P142 I144 F172 K174	Q48-F164 PolarHBondContact NE2-O 2.96Å; I139-F164 HydrophobicContact CD1-CD1 4.3Å; I139-F164 HydrophobicContact CD1-CE1 4.25Å; I139-F164 HydrophobicContact CG2-CD1 4.48Å; I139-F164 HydrophobicContact CG2-CE1 4.08Å; P142-F164 HydrophobicContact CB-CB 4.12Å; P142-F164 HydrophobicContact CB-CD1 3.79Å; P142-F164 HydrophobicContact CB-CD2 3.78Å; P142-F164 HydrophobicContact CB-CE1 4.09Å; P142-F164 HydrophobicContact CB-CE2 4.08Å; P142-F164 HydrophobicContact CB-CG 3.63Å; P142-F164 HydrophobicContact CB-CZ 4.22Å; P142-F164 WeakPolarHBondContact O-CE2 3.25Å; P142-F164 VanDerWaalsContact O-CZ 3.3Å; P142-F164 WeakPolarHBondContact O-CZ 3Å; I144-F164 HydrophobicContact CB-CE1 4.28Å; I144-F164 HydrophobicContact CB-CZ 4.42Å; I144-F164 HydrophobicContact CG2-CE1 3.64Å; I144-F164 HydrophobicContact CG2-CZ 3.79Å; F164-F172 HydrophobicContact CB-CB 4.17Å; F164-F172 HydrophobicContact CB-CD1 3.72Å; F164-F172 HydrophobicContact CB-CE1 4.47Å; F164-F172 HydrophobicContact CB-CG 4.18Å; F164-F172 HydrophobicContact CD1-CB 4.22Å; F164-K174 HydrophobicContact CD1-CB 4.27Å; F164-K174 HydrophobicContact CD1-CD 4.2Å; F164-K174 HydrophobicContact CE1-CD 4.02Å; F164-K174 HydrophobicContact CZ-CD 4.37Å
165	L	98.1	Very high	97.3	Very high	6 Å²	6	58.3 Å²	58.3	3%	0.031	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	146.1	179.4	-55.7	177.6	0	0	0	109.9	E52 E57 S163 F172 H173 L175	E52-L165 HydrophobicContact CG-CD2 4.15Å; E57-L165 HydrophobicContact CB-CD2 3.82Å; E57-L165 HydrophobicContact CG-CD2 4.27Å; S163-L165 PolarHBondContact O-N 2.8Å; L165-F172 CarbonylContact O-C 3.58Å; L165-F172 WeakPolarHBondContact O-CA 3.33Å; L165-F172 WeakPolarHBondContact O-CB 3.13Å; L165-H173 VanDerWaalsContact CB-CE1 3.49Å; L165-H173 WeakPolarHBondContact CB-CE1 3.45Å; L165-H173 WeakPolarHBondContact CB-NE2 3.22Å; L165-H173 WeakPolarHBondContact CD1-NE2 3.22Å; L165-H173 PolarHBondContact N-O 3.08Å; L165-H173 PolarHBondContact O-N 3.24Å; L165-L175 HydrophobicContact CD1-CD1 4.28Å
166	V	96.6	Very high	97.3	Very high	51 Å²	51	56.6 Å²	56.6	31%	0.309	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	129.2	-168.8	-179.4	0	0	0	0	111.3	I37 F172	I37-V166 HydrophobicContact CD1-CG2 4.1Å; I37-V166 HydrophobicContact CG2-CG2 3.65Å; V166-F172 HydrophobicContact CG2-CD1 4.26Å; V166-F172 HydrophobicContact CG2-CE1 3.91Å
167	N	96.4	Very high	97.3	Very high	30 Å²	30	54.3 Å²	54.3	16%	0.16	27%	0.267	C	S	.	.	P	Polyproline II helix	trans	-87	162.3	169.5	-70.2	-29.8	0	0	0	111.9	D137 D169 H170 S171 H173	D137-N167 PolarHBondContact OD1-ND2 2.77Å; N167-D169 VanDerWaalsContact CB-OD1 3.22Å; N167-D169 WeakPolarHBondContact CB-OD1 3.06Å; N167-D169 PolarHBondContact O-N 2.78Å; N167-H170 PolarHBondContact O-N 2.72Å; N167-S171 WeakPolarHBondContact CB-O 3.36Å; N167-S171 WeakPolarHBondContact CB-OG 3.44Å; N167-S171 PolarHBondContact N-O 2.85Å; N167-S171 PolarHBondContact ND2-OG 3.45Å; N167-H173 PolarHBondContact OD1-ND1 2.64Å
168	R	92.5	Very high	97.4	Very high	198 Å²	198	48 Å²	48	75%	0.747	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.5	-31.6	178.3	-67	-175.3	179.5	-176.7	1.1	113.2	D26 H170	D26-R168 IonicContact OD1-CZ 3.58Å; D26-R168 IonicContact OD1-NH1 3.78Å; D26-R168 PolarHBondContact OD1-NH1 3.42Å; D26-R168 IonicContact OD2-CZ 2.89Å; D26-R168 IonicContact OD2-NH1 2.77Å; D26-R168 PolarHBondContact OD2-NH1 3.08Å; R168-H170 VanDerWaalsContact C-N 3.29Å
169	D	94.5	Very high	97.5	Very high	103 Å²	103	50 Å²	50	55%	0.551	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.5	7.4	179.4	67.5	-5	0	0	0	113.8	N167 S171	N167-D169 VanDerWaalsContact CB-OD1 3.22Å; N167-D169 WeakPolarHBondContact CB-OD1 3.06Å; N167-D169 PolarHBondContact O-N 2.78Å; D169-S171 PolarHBondContact O-N 2.86Å; D169-S171 VanDerWaalsContact OD1-CB 3.29Å; D169-S171 WeakPolarHBondContact OD1-CB 3.38Å; D169-S171 PolarHBondContact OD1-N 2.82Å; D169-S171 PolarHBondContact OD1-OG 2.87Å; D169-S171 PolarHBondContact OD2-OG 3.16Å
170	H	95.6	Very high	97.4	Very high	145 Å²	145	48.5 Å²	48.5	67%	0.671	23%	0.228	S	C	*	.	S	Bend	trans	69	7.2	-175.8	-44.8	-59.6	0	0	0	115.9	N167 R168	N167-H170 PolarHBondContact O-N 2.72Å; R168-H170 VanDerWaalsContact C-N 3.29Å
171	S	97.8	Very high	97.4	Very high	7 Å²	7	48.3 Å²	48.3	5%	0.049	23%	0.233	C	C	.	.			trans	-71.6	178.6	158.8	73.2	0	0	0	0	110	N167 D169	N167-S171 WeakPolarHBondContact CB-O 3.36Å; N167-S171 WeakPolarHBondContact CB-OG 3.44Å; N167-S171 PolarHBondContact N-O 2.85Å; N167-S171 PolarHBondContact ND2-OG 3.45Å; D169-S171 PolarHBondContact O-N 2.86Å; D169-S171 VanDerWaalsContact OD1-CB 3.29Å; D169-S171 WeakPolarHBondContact OD1-CB 3.38Å; D169-S171 PolarHBondContact OD1-N 2.82Å; D169-S171 PolarHBondContact OD1-OG 2.87Å; D169-S171 PolarHBondContact OD2-OG 3.16Å
172	F	98.6	Very high	97.2	Very high	17 Å²	17	45.5 Å²	45.5	8%	0.075	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	154.1	179.4	-60.2	-95.8	0	0	0	111.4	V39 N138 I139 F140 P142 F164 L165 V166	V39-F172 HydrophobicContact CG1-CZ 4.49Å; V39-F172 HydrophobicContact CG2-CE1 3.76Å; V39-F172 HydrophobicContact CG2-CZ 3.85Å; N138-F172 PolarHBondContact N-O 3Å; I139-F172 WeakPolarHBondContact CA-O 3.03Å; I139-F172 HydrophobicContact CB-CB 4.18Å; I139-F172 VanDerWaalsContact CB-O 3.23Å; I139-F172 WeakPolarHBondContact CB-O 3.21Å; I139-F172 WeakPolarHBondContact CG1-O 3.44Å; I139-F172 PolarHBondContact N-O 3.05Å; I139-F172 WeakPolarHBondContact O-CD2 3.4Å; I139-F172 PolarHBondContact O-N 3.15Å; F140-F172 HydrophobicContact CD2-CD2 4.44Å; F140-F172 HydrophobicContact CD2-CE2 4.24Å; P142-F172 HydrophobicContact CB-CB 4.5Å; P142-F172 HydrophobicContact CB-CD1 4.27Å; P142-F172 HydrophobicContact CB-CD2 3.69Å; P142-F172 HydrophobicContact CB-CE1 4.43Å; P142-F172 HydrophobicContact CB-CE2 3.91Å; P142-F172 HydrophobicContact CB-CG 3.89Å; P142-F172 HydrophobicContact CB-CZ 4.27Å; P142-F172 HydrophobicContact CG-CD2 3.9Å; P142-F172 HydrophobicContact CG-CE1 4.43Å; P142-F172 HydrophobicContact CG-CE2 3.58Å; P142-F172 HydrophobicContact CG-CG 4.47Å; P142-F172 HydrophobicContact CG-CZ 3.86Å; F164-F172 HydrophobicContact CB-CB 4.17Å; F164-F172 HydrophobicContact CB-CD1 3.72Å; F164-F172 HydrophobicContact CB-CE1 4.47Å; F164-F172 HydrophobicContact CB-CG 4.18Å; F164-F172 HydrophobicContact CD1-CB 4.22Å; L165-F172 CarbonylContact O-C 3.58Å; L165-F172 WeakPolarHBondContact O-CA 3.33Å; L165-F172 WeakPolarHBondContact O-CB 3.13Å; V166-F172 HydrophobicContact CG2-CD1 4.26Å; V166-F172 HydrophobicContact CG2-CE1 3.91Å
173	H	98.6	Very high	97	Very high	30 Å²	30	46.5 Å²	46.5	14%	0.139	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	158.6	162.3	65.9	-90.9	0	0	0	110.7	F135 V136 D137 L165 N167	F135-H173 HydrophobicContact CE2-CB 3.85Å; F135-H173 AromaticContact CE2-CD2 3.76Å; F135-H173 AromaticContact CE2-CG 3.96Å; F135-H173 HydrophobicContact CZ-CB 4.12Å; V136-H173 CarbonylContact O-C 3.49Å; V136-H173 WeakPolarHBondContact O-CA 3.4Å; V136-H173 WeakPolarHBondContact O-CB 3.16Å; D137-H173 HydrophobicContact CB-CB 4.39Å; L165-H173 VanDerWaalsContact CB-CE1 3.49Å; L165-H173 WeakPolarHBondContact CB-CE1 3.45Å; L165-H173 WeakPolarHBondContact CB-NE2 3.22Å; L165-H173 WeakPolarHBondContact CD1-NE2 3.22Å; L165-H173 PolarHBondContact N-O 3.08Å; L165-H173 PolarHBondContact O-N 3.24Å; N167-H173 PolarHBondContact OD1-ND1 2.64Å
174	K	98.4	Very high	96.6	Very high	25 Å²	25	51 Å²	51	11%	0.109	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.5	143.7	179.6	-178.2	168.5	170.6	172.2	0	110	V136 I139 I144 I146 E161 T162 F164	V136-K174 PolarHBondContact N-O 2.03Å; V136-K174 PolarHBondContact O-N 2.98Å; I139-K174 HydrophobicContact CD1-CB 3.79Å; I144-K174 HydrophobicContact CG2-CD 4.14Å; I146-K174 HydrophobicContact CD1-CD 4.29Å; I146-K174 HydrophobicContact CD1-CG 4.3Å; E161-K174 WeakPolarHBondContact OE2-CE 3.47Å; E161-K174 IonicContact OE2-NZ 2.88Å; E161-K174 PolarHBondContact OE2-NZ 3.02Å; T162-K174 WeakPolarHBondContact O-CE 3.3Å; F164-K174 HydrophobicContact CD1-CB 4.27Å; F164-K174 HydrophobicContact CD1-CD 4.2Å; F164-K174 HydrophobicContact CE1-CD 4.02Å; F164-K174 HydrophobicContact CZ-CD 4.37Å
175	L	98.5	Very high	96.3	Very high	28 Å²	28	55.9 Å²	55.9	15%	0.147	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	133.5	176.2	-62.7	89.2	0	0	0	109.9	I133 C134 F135 E161 T162 L165 Y177	I133-L175 HydrophobicContact CG2-CD2 3.91Å; C134-L175 WeakPolarHBondContact O-CA 3.45Å; F135-L175 HydrophobicContact CD2-CD1 4.28Å; F135-L175 HydrophobicContact CD2-CD2 4.35Å; F135-L175 HydrophobicContact CD2-CG 4.04Å; E161-L175 VanDerWaalsContact CA-O 3.29Å; E161-L175 WeakPolarHBondContact CA-O 3.17Å; T162-L175 HydrophobicContact CG2-CB 3.99Å; T162-L175 HydrophobicContact CG2-CD1 4.31Å; T162-L175 PolarHBondContact N-O 2.88Å; T162-L175 PolarHBondContact OG1-N 2.86Å; L165-L175 HydrophobicContact CD1-CD1 4.28Å; L175-Y177 HydrophobicContact CB-CE2 3.75Å; L175-Y177 WeakPolarHBondContact CD2-OH 2.94Å
176	S	98.6	Very high	96.1	Very high	0 Å²	0	56.2 Å²	56.2	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	141	166.4	-174.6	0	0	0	0	109	C134 W148 Y160 E161	C134-S176 PolarHBondContact N-O 2.97Å; C134-S176 PolarHBondContact O-N 3.23Å; W148-S176 PolarHBondContact NE1-OG 2.91Å; Y160-S176 CarbonylContact O-C 3.55Å; Y160-S176 WeakPolarHBondContact O-CA 3.29Å; E161-S176 PolarHBondContact OE1-OG 2.89Å
177	Y	98.6	Very high	96.2	Very high	58 Å²	58	56.4 Å²	56.4	23%	0.227	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	142.9	-174.7	-58.1	-92.7	0	0	0	109.4	T131 L132 I133 V159 Y160 T162 L175	T131-Y177 HydrophobicContact CG2-CD1 4.05Å; T131-Y177 HydrophobicContact CG2-CG 4.49Å; L132-Y177 CarbonylContact O-C 3.55Å; L132-Y177 VanDerWaalsContact O-CA 3.31Å; L132-Y177 WeakPolarHBondContact O-CA 3.4Å; I133-Y177 HydrophobicContact CB-CD1 4.49Å; I133-Y177 HydrophobicContact CD1-CD1 4.35Å; I133-Y177 HydrophobicContact CD1-CE1 4.03Å; I133-Y177 HydrophobicContact CG1-CD1 3.82Å; I133-Y177 HydrophobicContact CG1-CE1 3.94Å; I133-Y177 HydrophobicContact CG2-CD1 4.34Å; I133-Y177 HydrophobicContact CG2-CE1 4.04Å; V159-Y177 VanDerWaalsContact CA-O 3.22Å; V159-Y177 WeakPolarHBondContact CA-O 3.41Å; Y160-Y177 AromaticContact CD1-CD2 3.6Å; Y160-Y177 HydrophobicContact CD1-CD2 3.6Å; Y160-Y177 AromaticContact CD1-CE2 4Å; Y160-Y177 HydrophobicContact CD1-CE2 4Å; Y160-Y177 HydrophobicContact CD1-CG 4.44Å; Y160-Y177 HydrophobicContact CE1-CD2 4.28Å; Y160-Y177 HydrophobicContact CE1-CE2 4.23Å; Y160-Y177 PolarHBondContact N-O 3Å; Y160-Y177 VanDerWaalsContact N-O 3.09Å; Y160-Y177 WeakPolarHBondContact O-CD2 3.34Å; Y160-Y177 PolarHBondContact O-N 3.05Å; T162-Y177 HydrophobicContact CG2-CE2 3.98Å; L175-Y177 HydrophobicContact CB-CE2 3.75Å; L175-Y177 WeakPolarHBondContact CD2-OH 2.94Å
178	L	98.7	Very high	96.3	Very high	3 Å²	3	55.1 Å²	55.1	2%	0.016	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	114.7	171.2	173.4	67.5	0	0	0	109.6	T131 L132 W148 V155 V159 Y188	T131-L178 CarbonylContact C-O 3.55Å; T131-L178 VanDerWaalsContact CA-O 3.31Å; T131-L178 WeakPolarHBondContact CA-O 3.49Å; L132-L178 HydrophobicContact CB-CB 4.49Å; L132-L178 PolarHBondContact N-O 3.48Å; L132-L178 PolarHBondContact O-N 3Å; W148-L178 HydrophobicContact CB-CD2 4.07Å; W148-L178 HydrophobicContact CD2-CB 3.64Å; W148-L178 HydrophobicContact CD2-CD2 3.9Å; W148-L178 HydrophobicContact CD2-CG 4.36Å; W148-L178 HydrophobicContact CE3-CB 4.13Å; W148-L178 HydrophobicContact CE3-CD2 3.82Å; W148-L178 HydrophobicContact CG-CB 3.89Å; W148-L178 HydrophobicContact CG-CD2 4.03Å; W148-L178 HydrophobicContact CG-CG 4.38Å; W148-L178 HydrophobicContact CZ2-CB 4.1Å; V155-L178 HydrophobicContact CG1-CD1 3.96Å; V155-L178 HydrophobicContact CG1-CD2 4.06Å; V155-L178 HydrophobicContact CG2-CD1 4.27Å; V159-L178 HydrophobicContact CG2-CD1 3.75Å; L178-Y188 HydrophobicContact CD2-CD1 3.62Å; L178-Y188 HydrophobicContact CD2-CE1 3.9Å
179	T	98.3	Very high	96.5	Very high	82 Å²	82	46.5 Å²	46.5	50%	0.503	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	132.7	169.3	61.5	0	0	0	0	110.3	N130 G158	N130-T179 WeakPolarHBondContact O-CA 3.44Å; G158-T179 VanDerWaalsContact CA-OG1 3.31Å; G158-T179 WeakPolarHBondContact CA-OG1 3.35Å; G158-T179 PolarHBondContact O-N 2.86Å; G158-T179 PolarHBondContact O-OG1 2.78Å
180	F	96.7	Very high	96.7	Very high	14 Å²	14	41.6 Å²	41.6	6%	0.061	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	163.9	-178.9	78.4	-64.1	0	0	0	111.7	N130 L132 P182 Y188 W205	N130-F180 HydrophobicContact CB-CD1 4.27Å; N130-F180 HydrophobicContact CB-CE1 3.65Å; N130-F180 HydrophobicContact CB-CZ 4.13Å; N130-F180 PolarHBondContact N-O 3.48Å; N130-F180 WeakPolarHBondContact O-CD1 3.23Å; N130-F180 PolarHBondContact O-N 2.85Å; L132-F180 HydrophobicContact CB-CE1 4.46Å; L132-F180 HydrophobicContact CD1-CE1 4.42Å; L132-F180 HydrophobicContact CD1-CZ 4.48Å; L132-F180 HydrophobicContact CD2-CE1 4.05Å; L132-F180 HydrophobicContact CD2-CZ 4.07Å; L132-F180 HydrophobicContact CG-CD1 3.97Å; L132-F180 HydrophobicContact CG-CE1 3.59Å; L132-F180 HydrophobicContact CG-CZ 3.92Å; F180-P182 HydrophobicContact CD2-CB 4.43Å; F180-P182 HydrophobicContact CD2-CG 4.19Å; F180-P182 HydrophobicContact CE2-CB 3.77Å; F180-P182 HydrophobicContact CE2-CG 3.57Å; F180-P182 HydrophobicContact CZ-CB 4.38Å; F180-P182 HydrophobicContact CZ-CG 3.8Å; F180-Y188 HydrophobicContact CB-CE1 4.23Å; F180-Y188 HydrophobicContact CD2-CE1 4.43Å; F180-Y188 AromaticContact CD2-CE2 3.86Å; F180-Y188 HydrophobicContact CD2-CE2 3.86Å; F180-Y188 AromaticContact CD2-CZ 3.71Å; F180-Y188 HydrophobicContact CE2-CE2 4.23Å; F180-W205 AromaticContact CE2-CH2 3.79Å; F180-W205 HydrophobicContact CE2-CH2 3.79Å; F180-W205 AromaticContact CE2-CZ3 3.65Å; F180-W205 HydrophobicContact CE2-CZ3 3.65Å; F180-W205 AromaticContact CZ-CH2 3.66Å; F180-W205 HydrophobicContact CZ-CH2 3.66Å; F180-W205 AromaticContact CZ-CZ3 3.85Å; F180-W205 HydrophobicContact CZ-CZ3 3.85Å
181	I	96.3	Very high	96.9	Very high	103 Å²	103	37.4 Å²	37.4	53%	0.528	19%	0.194	S	C	.	.			trans	-108.1	114.1	167.2	-59	178.5	0	0	0	105.8	S183	I181-S183 PolarHBondContact O-N 2.93Å
182	P	94.3	Very high	96.9	Very high	3 Å²	3	37.1 Å²	37.1	2%	0.019	19%	0.192	C	C	.	.			trans	-59.3	132.4	-178.5	-20	30.2	0	0	0	111.9	V124 L126 G127 Q128 N130 F180	V124-P182 HydrophobicContact CG1-CB 3.54Å; V124-P182 HydrophobicContact CG1-CG 3.72Å; L126-P182 HydrophobicContact CD2-CB 4.3Å; G127-P182 PolarHBondContact N-O 2.85Å; G127-P182 VanDerWaalsContact N-O 3.13Å; Q128-P182 WeakPolarHBondContact O-CD 3.36Å; N130-P182 HydrophobicContact CB-CG 4.2Å; F180-P182 HydrophobicContact CD2-CB 4.43Å; F180-P182 HydrophobicContact CD2-CG 4.19Å; F180-P182 HydrophobicContact CE2-CB 3.77Å; F180-P182 HydrophobicContact CE2-CG 3.57Å; F180-P182 HydrophobicContact CZ-CB 4.38Å; F180-P182 HydrophobicContact CZ-CG 3.8Å
183	S	92.7	Very high	97	Very high	32 Å²	32	39.3 Å²	39.3	22%	0.224	20%	0.203	C	C	.	.			trans	-139.4	144.5	174.3	171.5	0	0	0	0	108.2	I181 D185 D186 P207	I181-S183 PolarHBondContact O-N 2.93Å; S183-D185 PolarHBondContact O-N 3.05Å; S183-D185 PolarHBondContact OG-N 3.26Å; S183-D186 WeakPolarHBondContact CB-OD2 3.42Å; S183-D186 PolarHBondContact O-N 3.2Å; S183-P207 WeakPolarHBondContact O-CG 3.49Å
184	D	90.1	Very high	97	Very high	107 Å²	107	38.6 Å²	38.6	57%	0.572	20%	0.199	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.3	-20.3	174.4	53.3	-25.8	0	0	0	114.1	I209	D184-I209 HydrophobicContact CB-CD1 3.43Å; D184-I209 VanDerWaalsContact CB-CD1 3.43Å
185	D	92.1	Very high	96.9	Very high	132 Å²	132	45 Å²	45	71%	0.706	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.4	-10.8	178.9	-66.4	-41.4	0	0	0	113.4	S183	S183-D185 PolarHBondContact O-N 3.05Å; S183-D185 PolarHBondContact OG-N 3.26Å
186	D	95.1	Very high	96.9	Very high	12 Å²	12	44.9 Å²	44.9	6%	0.064	23%	0.228	C	C	.	.			trans	-106.2	127.5	-172.7	-71.5	-53.3	0	0	0	112.6	R150 N151 S183 Y188	R150-D186 IonicContact CZ-OD1 3.23Å; R150-D186 IonicContact CZ-OD2 2.72Å; R150-D186 VanDerWaalsContact CZ-OD2 3.23Å; R150-D186 IonicContact NE-OD1 3.28Å; R150-D186 PolarHBondContact NE-OD1 2.96Å; R150-D186 IonicContact NE-OD2 2.69Å; R150-D186 PolarHBondContact NE-OD2 3.3Å; R150-D186 VanDerWaalsContact NH2-CG 3.28Å; R150-D186 IonicContact NH2-OD1 2.62Å; R150-D186 PolarHBondContact NH2-OD1 2.83Å; R150-D186 IonicContact NH2-OD2 3.81Å; R150-D186 PolarHBondContact NH2-OD2 3.06Å; N151-D186 PolarHBondContact ND2-OD1 3.43Å; S183-D186 WeakPolarHBondContact CB-OD2 3.42Å; S183-D186 PolarHBondContact O-N 3.2Å; D186-Y188 HydrophobicContact CB-CE2 3.63Å
187	I	97.1	Very high	96.9	Very high	56 Å²	56	46.6 Å²	46.6	29%	0.287	24%	0.237	S	C	.	.			trans	-109	150.2	167.3	60.7	167.7	0	0	0	111	R150 N151 E206	R150-I187 WeakPolarHBondContact CA-O 3.31Å; N151-I187 PolarHBondContact N-O 2.83Å; N151-I187 WeakPolarHBondContact OD1-CG1 3.24Å; N151-I187 PolarHBondContact OD1-N 2.87Å; I187-E206 HydrophobicContact CG2-CB 4.08Å
188	Y	98.4	Very high	96.8	Very high	3 Å²	3	53.8 Å²	53.8	1%	0.012	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	143.2	-177.6	-61.2	-94.9	0	0	0	110.6	L132 L149 R150 L178 F180 D186 H204 W205	L132-Y188 HydrophobicContact CD1-CD1 4.01Å; L132-Y188 HydrophobicContact CD1-CD2 4Å; L132-Y188 HydrophobicContact CD1-CG 3.59Å; L149-Y188 CarbonylContact O-C 3.58Å; L149-Y188 VanDerWaalsContact O-CA 3.25Å; L149-Y188 WeakPolarHBondContact O-CA 3.23Å; R150-Y188 HydrophobicContact CB-CD1 4.09Å; R150-Y188 HydrophobicContact CB-CE1 3.96Å; R150-Y188 HydrophobicContact CG-CD1 4.25Å; R150-Y188 HydrophobicContact CG-CE1 3.76Å; L178-Y188 HydrophobicContact CD2-CD1 3.62Å; L178-Y188 HydrophobicContact CD2-CE1 3.9Å; F180-Y188 HydrophobicContact CB-CE1 4.23Å; F180-Y188 HydrophobicContact CD2-CE1 4.43Å; F180-Y188 AromaticContact CD2-CE2 3.86Å; F180-Y188 HydrophobicContact CD2-CE2 3.86Å; F180-Y188 AromaticContact CD2-CZ 3.71Å; F180-Y188 HydrophobicContact CE2-CE2 4.23Å; D186-Y188 HydrophobicContact CB-CE2 3.63Å; Y188-H204 CarbonylContact O-C 3.51Å; Y188-W205 AromaticContact CD2-CE3 3.77Å; Y188-W205 HydrophobicContact CD2-CE3 3.77Å; Y188-W205 AromaticContact CD2-CZ3 3.88Å; Y188-W205 HydrophobicContact CD2-CZ3 3.88Å; Y188-W205 HydrophobicContact CE2-CZ3 4.26Å; Y188-W205 HydrophobicContact CG-CE3 4.39Å; Y188-W205 PolarHBondContact N-O 2.91Å; Y188-W205 PolarHBondContact O-N 2.75Å; Y188-W205 VanDerWaalsContact O-O 3.12Å
189	D	98.6	Very high	96.8	Very high	16 Å²	16	60.9 Å²	60.9	9%	0.086	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	132.6	170.8	-52.1	-76.1	0	0	0	109.8	L149 L202 K203 H204	L149-D189 HydrophobicContact CB-CB 4.14Å; L149-D189 HydrophobicContact CD1-CB 4.28Å; L149-D189 HydrophobicContact CG-CB 4.47Å; L149-D189 PolarHBondContact N-O 2.91Å; L149-D189 PolarHBondContact O-N 2.79Å; D189-L202 HydrophobicContact CB-CD2 4.05Å; D189-K203 WeakPolarHBondContact CA-O 3.29Å; D189-H204 WeakPolarHBondContact OD1-CA 3.39Å; D189-H204 IonicContact OD1-CG 3.96Å; D189-H204 IonicContact OD1-ND1 2.85Å; D189-H204 PolarHBondContact OD1-ND1 3.14Å
190	C	98.7	Very high	96.8	Very high	0 Å²	0	59.9 Å²	59.9	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	111	161	178.5	0	0	0	0	108.6	V118 C134 W148 K203	V118-C190 HydrophobicContact CG2-CB 3.46Å; V118-C190 VanDerWaalsContact CG2-CB 3.46Å; C134-C190 HydrophobicContact CB-CB 3.63Å; C134-C190 WeakPolarHBondContact CB-SG 3.25Å; C134-C190 WeakPolarHBondContact SG-CB 3.5Å; C134-C190 CovalentContact SG-SG 2.03Å; C134-C190 PolarHBondContact SG-SG 2.89Å; W148-C190 HydrophobicContact CE3-CB 4.37Å; W148-C190 HydrophobicContact CH2-CB 4.29Å; W148-C190 HydrophobicContact CZ3-CB 4.09Å; C190-K203 HydrophobicContact CB-CB 4.37Å; C190-K203 PolarHBondContact N-O 2.69Å; C190-K203 PolarHBondContact O-N 3.02Å
191	K	98.8	Very high	96.8	Very high	57 Å²	57	61.1 Å²	61.1	25%	0.248	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	126.7	174.5	-172.7	-174.6	173.6	-155.7	0	109.7	I146 T147 L149 E193 P200 V201 L202	I146-K191 CarbonylContact C-O 3.56Å; I146-K191 WeakPolarHBondContact CA-O 3.44Å; T147-K191 PolarHBondContact N-O 2.93Å; T147-K191 WeakPolarHBondContact O-CB 3.43Å; T147-K191 PolarHBondContact O-N 2.93Å; L149-K191 HydrophobicContact CD1-CB 4.5Å; K191-E193 VanDerWaalsContact CE-OE1 3.23Å; K191-E193 WeakPolarHBondContact CE-OE1 3.42Å; K191-E193 VanDerWaalsContact NZ-CD 3.34Å; K191-E193 IonicContact NZ-OE1 2.75Å; K191-E193 PolarHBondContact NZ-OE1 2.93Å; K191-E193 IonicContact NZ-OE2 2.84Å; K191-P200 HydrophobicContact CG-CB 4.21Å; K191-V201 CarbonylContact C-O 3.56Å; K191-V201 WeakPolarHBondContact CA-O 3.36Å; K191-L202 HydrophobicContact CB-CD2 3.56Å; K191-L202 HydrophobicContact CD-CD2 4.36Å; K191-L202 HydrophobicContact CG-CD2 3.71Å
192	V	98.8	Very high	96.9	Very high	1 Å²	1	60.9 Å²	60.9	1%	0.006	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	125	179.9	179.5	0	0	0	0	110.1	P114 A116 V136 I144 N145 I146 L197 P200 V201	P114-V192 HydrophobicContact CG-CG1 4.27Å; A116-V192 HydrophobicContact CB-CG2 3.88Å; V136-V192 HydrophobicContact CG1-CG1 4.1Å; V136-V192 HydrophobicContact CG2-CG2 3.87Å; I144-V192 HydrophobicContact CD1-CG1 3.59Å; I144-V192 HydrophobicContact CG1-CG1 3.94Å; N145-V192 WeakPolarHBondContact O-CA 3.44Å; I146-V192 HydrophobicContact CG1-CG2 4.47Å; V192-L197 HydrophobicContact CG1-CD1 4.45Å; V192-P200 CarbonylContact O-C 3.58Å; V192-P200 WeakPolarHBondContact O-CA 3.35Å; V192-V201 PolarHBondContact N-O 2.82Å; V192-V201 PolarHBondContact O-N 3.38Å
193	E	98.8	Very high	97.1	Very high	64 Å²	64	64.7 Å²	64.7	30%	0.299	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	128.9	175.7	-52.3	177.8	125.3	0	0	109.7	I144 N145 K191 P200	I144-E193 WeakPolarHBondContact CG1-O 3.43Å; N145-E193 HydrophobicContact CB-CB 4.19Å; N145-E193 PolarHBondContact N-O 3.48Å; N145-E193 PolarHBondContact ND2-OE2 3.08Å; N145-E193 PolarHBondContact O-N 3.36Å; K191-E193 VanDerWaalsContact CE-OE1 3.23Å; K191-E193 WeakPolarHBondContact CE-OE1 3.42Å; K191-E193 VanDerWaalsContact NZ-CD 3.34Å; K191-E193 IonicContact NZ-OE1 2.75Å; K191-E193 PolarHBondContact NZ-OE1 2.93Å; K191-E193 IonicContact NZ-OE2 2.84Å; E193-P200 HydrophobicContact CG-CB 3.88Å; E193-P200 HydrophobicContact CG-CG 3.94Å
194	H	98.6	Very high	97.3	Very high	15 Å²	15	67.6 Å²	67.6	7%	0.069	34%	0.335	C	S	.	.			trans	-151.8	150.4	-177	-175.1	-97.7	0	0	0	110.1	E112 P114 F140 P141 V143 I144 G196 L197	E112-H194 PolarHBondContact O-CE1 3.01Å; E112-H194 PolarHBondContact O-ND1 3.3Å; P114-H194 WeakPolarHBondContact CD-ND1 3.21Å; P114-H194 HydrophobicContact CG-CB 3.59Å; F140-H194 PolarHBondContact O-CE1 3.11Å; P141-H194 PolarHBondContact O-NE2 2.74Å; P141-H194 VanDerWaalsContact O-NE2 3.1Å; V143-H194 PolarHBondContact O-CD2 3.15Å; I144-H194 HydrophobicContact CG1-CB 4.36Å; H194-G196 PolarHBondContact ND1-N 3.46Å; H194-G196 PolarHBondContact O-N 3.45Å; H194-L197 HydrophobicContact CB-CD1 4.03Å; H194-L197 HydrophobicContact CB-CG 4.19Å; H194-L197 PolarHBondContact O-N 2.93Å
195	W	97.7	Very high	97.7	Very high	160 Å²	160	64 Å²	64	61%	0.606	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.4	-16.5	-177.2	-57.2	-31.5	0	0	0	114.8	N111 P141 V143 L197	N111-W195 WeakPolarHBondContact ND2-CB 3.16Å; N111-W195 PolarHBondContact ND2-O 2.89Å; P141-W195 HydrophobicContact CG-CE3 3.57Å; P141-W195 HydrophobicContact CG-CZ3 3.56Å; V143-W195 HydrophobicContact CB-CH2 4Å; V143-W195 HydrophobicContact CB-CZ2 4.21Å; V143-W195 HydrophobicContact CB-CZ3 4.29Å; V143-W195 HydrophobicContact CG1-CH2 4.08Å; V143-W195 HydrophobicContact CG1-CZ2 3.85Å; V143-W195 HydrophobicContact CG2-CH2 3.77Å; V143-W195 HydrophobicContact CG2-CZ2 4.39Å; V143-W195 HydrophobicContact CG2-CZ3 4.1Å; W195-L197 VanDerWaalsContact C-N 3.34Å
196	G	97.6	Very high	97.8	Very high	25 Å²	25	63.2 Å²	63.2	26%	0.258	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.8	-0.5	172.9	0	0	0	0	0	114.3	E112 H194	E112-G196 WeakPolarHBondContact O-CA 3.37Å; H194-G196 PolarHBondContact ND1-N 3.46Å; H194-G196 PolarHBondContact O-N 3.45Å
197	L	98.4	Very high	97.6	Very high	36 Å²	36	63.4 Å²	63.4	19%	0.188	31%	0.307	C	S	.	.			trans	-103.4	136.3	175.6	-61.2	172	0	0	0	110.1	A113 P114 V192 H194 W195 E199 V201	A113-L197 HydrophobicContact CB-CD2 4.04Å; P114-L197 HydrophobicContact CG-CD1 4.02Å; P114-L197 HydrophobicContact CG-CG 4.24Å; V192-L197 HydrophobicContact CG1-CD1 4.45Å; H194-L197 HydrophobicContact CB-CD1 4.03Å; H194-L197 HydrophobicContact CB-CG 4.19Å; H194-L197 PolarHBondContact O-N 2.93Å; W195-L197 VanDerWaalsContact C-N 3.34Å; L197-E199 VanDerWaalsContact C-N 3.33Å; L197-E199 WeakPolarHBondContact CB-O 3.3Å; L197-V201 HydrophobicContact CD1-CB 4.34Å; L197-V201 HydrophobicContact CD1-CG2 3.83Å; L197-V201 HydrophobicContact CD2-CG2 3.9Å; L197-V201 HydrophobicContact CG-CG2 4.47Å
198	E	97.8	Very high	96.9	Very high	209 Å²	209	69.7 Å²	69.7	98%	0.977	34%	0.335	S	S	*	.	S	Bend	trans	-69.6	-35.4	171.8	-65.2	-175.1	175.1	0	0	111.5
199	E	97.9	Very high	95.5	Very high	152 Å²	152	73.5 Å²	73.5	71%	0.71	36%	0.355	S	S	*	.	S	Bend	trans	-139.5	154.1	177.3	62.6	-177.9	177.3	0	0	111.3	L197 V201	L197-E199 VanDerWaalsContact C-N 3.33Å; L197-E199 WeakPolarHBondContact CB-O 3.3Å; E199-V201 PolarHBondContact O-N 2.95Å
200	P	98.1	Very high	93.9	Very high	60 Å²	60	78.2 Å²	78.2	39%	0.39	39%	0.387	S	S	.	.			trans	-56.1	133.3	175.4	-25.9	35.7	0	0	0	112.3	K191 V192 E193	K191-P200 HydrophobicContact CG-CB 4.21Å; V192-P200 CarbonylContact O-C 3.58Å; V192-P200 WeakPolarHBondContact O-CA 3.35Å; E193-P200 HydrophobicContact CG-CB 3.88Å; E193-P200 HydrophobicContact CG-CG 3.94Å
201	V	97.4	Very high	92	Very high	40 Å²	40	82.1 Å²	82.1	24%	0.242	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	127.9	174.1	169.9	0	0	0	0	108.9	K191 V192 L197 E199 K203	K191-V201 CarbonylContact C-O 3.56Å; K191-V201 WeakPolarHBondContact CA-O 3.36Å; V192-V201 PolarHBondContact N-O 2.82Å; V192-V201 PolarHBondContact O-N 3.38Å; L197-V201 HydrophobicContact CD1-CB 4.34Å; L197-V201 HydrophobicContact CD1-CG2 3.83Å; L197-V201 HydrophobicContact CD2-CG2 3.9Å; L197-V201 HydrophobicContact CG-CG2 4.47Å; E199-V201 PolarHBondContact O-N 2.95Å; V201-K203 HydrophobicContact CG1-CD 4.27Å; V201-K203 HydrophobicContact CG1-CG 4.08Å
202	L	98.1	Very high	90.2	Very high	98 Å²	98	85 Å²	85	51%	0.513	44%	0.443	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	118.5	170.2	-70.9	168.1	0	0	0	109.1	L149 D189 K191	L149-L202 HydrophobicContact CD1-CD2 3.87Å; D189-L202 HydrophobicContact CB-CD2 4.05Å; K191-L202 HydrophobicContact CB-CD2 3.56Å; K191-L202 HydrophobicContact CD-CD2 4.36Å; K191-L202 HydrophobicContact CG-CD2 3.71Å
203	K	98.3	Very high	88	Confident	83 Å²	83	91.1 Å²	91.1	36%	0.361	47%	0.473	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	102.7	171.2	-66.9	-66.5	170.9	152.6	0	109.3	A116 V118 D189 C190 V201	A116-K203 HydrophobicContact CB-CD 4.44Å; A116-K203 HydrophobicContact CB-CG 3.55Å; A116-K203 WeakPolarHBondContact O-CD 3.23Å; A116-K203 WeakPolarHBondContact O-CE 3.26Å; A116-K203 WeakPolarHBondContact O-CG 3.32Å; A116-K203 PolarHBondContact O-NZ 3.41Å; V118-K203 HydrophobicContact CB-CB 4.46Å; V118-K203 HydrophobicContact CG2-CB 3.55Å; D189-K203 WeakPolarHBondContact CA-O 3.29Å; C190-K203 HydrophobicContact CB-CB 4.37Å; C190-K203 PolarHBondContact N-O 2.69Å; C190-K203 PolarHBondContact O-N 3.02Å; V201-K203 HydrophobicContact CG1-CD 4.27Å; V201-K203 HydrophobicContact CG1-CG 4.08Å
204	H	98.1	Very high	86.2	Confident	94 Å²	94	91 Å²	91	44%	0.435	48%	0.479	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	143.9	179.2	-171.5	71.7	0	0	0	111.7	Y188 D189 E206	Y188-H204 CarbonylContact O-C 3.51Å; D189-H204 WeakPolarHBondContact OD1-CA 3.39Å; D189-H204 IonicContact OD1-CG 3.96Å; D189-H204 IonicContact OD1-ND1 2.85Å; D189-H204 PolarHBondContact OD1-ND1 3.14Å; H204-E206 IonicContact NE2-OE2 3.96Å
205	W	97.6	Very high	84.5	Confident	32 Å²	32	97.7 Å²	97.7	12%	0.121	51%	0.511	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146	133.6	171.8	-175.2	89.1	0	0	0	110.2	V118 P120 V124 L132 F180 Y188 P207	V118-W205 HydrophobicContact CB-CB 4.32Å; V118-W205 HydrophobicContact CG1-CB 3.62Å; V118-W205 HydrophobicContact CG1-CG 3.93Å; P120-W205 HydrophobicContact CB-CZ2 4.46Å; P120-W205 HydrophobicContact CG-CZ2 4.43Å; V124-W205 HydrophobicContact CG1-CH2 4.41Å; V124-W205 HydrophobicContact CG2-CH2 4.08Å; V124-W205 HydrophobicContact CG2-CZ2 3.8Å; L132-W205 HydrophobicContact CD1-CD2 4.08Å; L132-W205 HydrophobicContact CD1-CE3 3.61Å; L132-W205 HydrophobicContact CD1-CZ3 4.1Å; L132-W205 HydrophobicContact CD2-CD2 3.43Å; L132-W205 VanDerWaalsContact CD2-CD2 3.43Å; L132-W205 HydrophobicContact CD2-CE3 3.66Å; L132-W205 HydrophobicContact CD2-CG 3.92Å; L132-W205 HydrophobicContact CD2-CH2 4.12Å; L132-W205 HydrophobicContact CD2-CZ2 3.93Å; L132-W205 HydrophobicContact CD2-CZ3 3.99Å; L132-W205 HydrophobicContact CG-CD2 4.4Å; L132-W205 HydrophobicContact CG-CE3 4.22Å; L132-W205 HydrophobicContact CG-CZ3 4.48Å; F180-W205 AromaticContact CE2-CH2 3.79Å; F180-W205 HydrophobicContact CE2-CH2 3.79Å; F180-W205 AromaticContact CE2-CZ3 3.65Å; F180-W205 HydrophobicContact CE2-CZ3 3.65Å; F180-W205 AromaticContact CZ-CH2 3.66Å; F180-W205 HydrophobicContact CZ-CH2 3.66Å; F180-W205 AromaticContact CZ-CZ3 3.85Å; F180-W205 HydrophobicContact CZ-CZ3 3.85Å; Y188-W205 AromaticContact CD2-CE3 3.77Å; Y188-W205 HydrophobicContact CD2-CE3 3.77Å; Y188-W205 AromaticContact CD2-CZ3 3.88Å; Y188-W205 HydrophobicContact CD2-CZ3 3.88Å; Y188-W205 HydrophobicContact CE2-CZ3 4.26Å; Y188-W205 HydrophobicContact CG-CE3 4.39Å; Y188-W205 PolarHBondContact N-O 2.91Å; Y188-W205 PolarHBondContact O-N 2.75Å; Y188-W205 VanDerWaalsContact O-O 3.12Å; W205-P207 HydrophobicContact CH2-CB 4.07Å; W205-P207 HydrophobicContact CH2-CG 3.75Å; W205-P207 HydrophobicContact CZ3-CG 3.8Å
206	E	94.6	Very high	82.9	Confident	114 Å²	114	96.1 Å²	96.1	53%	0.533	51%	0.513	S	S	.	.			trans	-135.7	152.1	171.7	62.4	-177.3	-179.3	0	0	109.2	I187 H204 E208	I187-E206 HydrophobicContact CG2-CB 4.08Å; H204-E206 IonicContact NE2-OE2 3.96Å; E206-E208 PolarHBondContact O-N 3.31Å
207	P	90.4	Very high	81.5	Confident	16 Å²	16	97.9 Å²	97.9	10%	0.104	52%	0.519	C	S	.	.			trans	-63.2	119.9	176.2	-18.3	30.4	0	0	0	111	V124 S183 W205 I209	V124-P207 HydrophobicContact CG1-CB 4.27Å; S183-P207 WeakPolarHBondContact O-CG 3.49Å; W205-P207 HydrophobicContact CH2-CB 4.07Å; W205-P207 HydrophobicContact CH2-CG 3.75Å; W205-P207 HydrophobicContact CZ3-CG 3.8Å; P207-I209 HydrophobicContact CB-CG1 4.38Å; P207-I209 PolarHBondContact O-N 2.95Å
208	E	81.9	Confident	80.3	Confident	189 Å²	189	102.3 Å²	102.3	88%	0.883	54%	0.539	S	S	*	.			trans	-72.1	95.8	168.1	-69.9	-175.1	-172	0	0	109.4	E206	E206-E208 PolarHBondContact O-N 3.31Å
209	I	69.7	Low	79.3	Confident	82 Å²	82	96.1 Å²	96.1	42%	0.421	52%	0.516	S	S	.	.	P	Polyproline II helix	trans	-85.1	123.2	174.8	-57.3	169.7	0	0	0	107.4	L126 D184 P207 A211	L126-I209 HydrophobicContact CD1-CD1 4.37Å; D184-I209 HydrophobicContact CB-CD1 3.43Å; D184-I209 VanDerWaalsContact CB-CD1 3.43Å; P207-I209 HydrophobicContact CB-CG1 4.38Å; P207-I209 PolarHBondContact O-N 2.95Å; I209-A211 PolarHBondContact O-N 2.84Å
210	P	64	Low	78.6	Confident	116 Å²	116	92.8 Å²	92.8	75%	0.753	51%	0.506	S	S	*	.	P	Polyproline II helix	trans	-55.7	117.2	166.9	-18.5	29.7	0	0	0	107.2	P212	P210-P212 VanDerWaalsContact O-N 3.16Å
211	A	60.6	Low	77.9	Confident	82 Å²	82	94.5 Å²	94.5	68%	0.678	51%	0.514	S	S	*	.	P	Polyproline II helix	trans	-48	129.7	178	0	0	0	0	0	108.1	I209 M213	I209-A211 PolarHBondContact O-N 2.84Å; A211-M213 PolarHBondContact O-N 3.42Å
212	P	60	Low	77.3	Confident	116 Å²	116	96.1 Å²	96.1	75%	0.753	53%	0.527	S	S	*	.	P	Polyproline II helix	trans	-51.7	124.5	172.9	21	-30.1	0	0	0	106.1	P210 S214	P210-P212 VanDerWaalsContact O-N 3.16Å; P212-S214 PolarHBondContact O-N 2.87Å
213	M	52.8	Low	76.8	Confident	131 Å²	131	94.2 Å²	94.2	65%	0.645	53%	0.525	S	S	*	.			trans	-48.3	114.8	177.5	-78.9	-173	62.1	0	0	106.6	A211 E215	A211-M213 PolarHBondContact O-N 3.42Å; M213-E215 PolarHBondContact O-N 2.76Å
214	S	60.3	Low	76.4	Confident	60 Å²	60	95.2 Å²	95.2	42%	0.42	53%	0.534	S	S	.	.			trans	-54.9	138.1	177.7	175	0	0	0	0	107.1	P212 L216 T217 E218	P212-S214 PolarHBondContact O-N 2.87Å; S214-L216 PolarHBondContact O-N 2.88Å; S214-L216 PolarHBondContact OG-N 2.84Å; S214-T217 PolarHBondContact N-OG1 3.34Å; S214-T217 WeakPolarHBondContact O-CA 3.5Å; S214-T217 WeakPolarHBondContact O-CB 3.36Å; S214-T217 PolarHBondContact O-N 2.85Å; S214-T217 PolarHBondContact O-OG1 2.88Å; S214-E218 PolarHBondContact O-N 2.89Å
215	E	63.8	Low	76	Confident	157 Å²	157	92.9 Å²	92.9	73%	0.734	54%	0.536	S	S	*	.	H	α-helix	trans	-51.8	-25.7	175.7	-66.6	-146.3	162.8	0	0	112.2	M213 T217 E218 T219	M213-E215 PolarHBondContact O-N 2.76Å; E215-T217 PolarHBondContact O-N 2.91Å; E215-E218 PolarHBondContact O-N 3.19Å; E215-T219 WeakPolarHBondContact O-CB 3.49Å; E215-T219 VanDerWaalsContact O-CG2 3.29Å; E215-T219 WeakPolarHBondContact O-CG2 3.18Å; E215-T219 PolarHBondContact O-N 3.05Å; E215-T219 PolarHBondContact O-OG1 3.24Å
216	L	63.9	Low	75.8	Confident	126 Å²	126	96.9 Å²	96.9	66%	0.66	56%	0.558	S	S	*	*	H	α-helix	trans	-61.6	-38.4	172	-63.8	171.4	0	0	0	113	S214 T219 V220	S214-L216 PolarHBondContact O-N 2.88Å; S214-L216 PolarHBondContact OG-N 2.84Å; L216-T219 VanDerWaalsContact CA-OG1 3.3Å; L216-T219 WeakPolarHBondContact CA-OG1 3.14Å; L216-T219 PolarHBondContact O-OG1 2.63Å; L216-V220 VanDerWaalsContact O-CB 3.28Å; L216-V220 WeakPolarHBondContact O-CB 3.45Å; L216-V220 WeakPolarHBondContact O-CG2 3.38Å; L216-V220 PolarHBondContact O-N 2.82Å
217	T	68.6	Low	75.5	Confident	63 Å²	63	94 Å²	94	39%	0.387	55%	0.551	S	S	.	*	H	α-helix	trans	-72.9	-38.5	177.6	60.2	0	0	0	0	111.9	S214 E215 V220 V221	S214-T217 PolarHBondContact N-OG1 3.34Å; S214-T217 WeakPolarHBondContact O-CA 3.5Å; S214-T217 WeakPolarHBondContact O-CB 3.36Å; S214-T217 PolarHBondContact O-N 2.85Å; S214-T217 PolarHBondContact O-OG1 2.88Å; E215-T217 PolarHBondContact O-N 2.91Å; T217-V220 PolarHBondContact O-N 3.39Å; T217-V221 WeakPolarHBondContact O-CB 3.22Å; T217-V221 WeakPolarHBondContact O-CG2 3.25Å; T217-V221 PolarHBondContact O-N 3.08Å
218	E	73.6	Confident	75.7	Confident	128 Å²	128	98.2 Å²	98.2	60%	0.598	58%	0.576	S	S	*	*	H	α-helix	trans	-67.2	-44.6	176.2	-168.2	177.7	174.9	0	0	111.5	S214 E215 V220 V221 C222	S214-E218 PolarHBondContact O-N 2.89Å; E215-E218 PolarHBondContact O-N 3.19Å; E218-V220 PolarHBondContact O-N 2.75Å; E218-V221 PolarHBondContact O-N 3.32Å; E218-C222 VanDerWaalsContact O-CB 3.28Å; E218-C222 WeakPolarHBondContact O-CB 3.18Å; E218-C222 PolarHBondContact O-N 3.2Å
219	T	76.7	Confident	76.1	Confident	80 Å²	80	91 Å²	91	49%	0.491	55%	0.552	S	S	.	*	H	α-helix	trans	-63.5	-40	175.5	49.9	0	0	0	0	112.4	E215 L216 C222 A223	E215-T219 WeakPolarHBondContact O-CB 3.49Å; E215-T219 VanDerWaalsContact O-CG2 3.29Å; E215-T219 WeakPolarHBondContact O-CG2 3.18Å; E215-T219 PolarHBondContact O-N 3.05Å; E215-T219 PolarHBondContact O-OG1 3.24Å; L216-T219 VanDerWaalsContact CA-OG1 3.3Å; L216-T219 WeakPolarHBondContact CA-OG1 3.14Å; L216-T219 PolarHBondContact O-OG1 2.63Å; T219-C222 PolarHBondContact O-N 3.19Å; T219-A223 VanDerWaalsContact O-CB 3.23Å; T219-A223 WeakPolarHBondContact O-CB 3.5Å; T219-A223 PolarHBondContact O-N 3.16Å
220	V	82.1	Confident	77.2	Confident	82 Å²	82	92.4 Å²	92.4	50%	0.497	56%	0.56	S	S	.	*	H	α-helix	trans	-65.9	-45.8	175.7	168.2	0	0	0	0	111.3	L216 T217 E218 C222 A223 L224	L216-V220 VanDerWaalsContact O-CB 3.28Å; L216-V220 WeakPolarHBondContact O-CB 3.45Å; L216-V220 WeakPolarHBondContact O-CG2 3.38Å; L216-V220 PolarHBondContact O-N 2.82Å; T217-V220 PolarHBondContact O-N 3.39Å; E218-V220 PolarHBondContact O-N 2.75Å; V220-C222 VanDerWaalsContact C-N 3.33Å; V220-C222 PolarHBondContact O-N 3.03Å; V220-A223 PolarHBondContact O-N 3.47Å; V220-L224 HydrophobicContact CG1-CD1 3.74Å; V220-L224 HydrophobicContact CG1-CG 4.33Å; V220-L224 WeakPolarHBondContact O-CB 3.28Å; V220-L224 VanDerWaalsContact O-CG 3.24Å; V220-L224 WeakPolarHBondContact O-CG 3.48Å; V220-L224 PolarHBondContact O-N 2.88Å
221	V	84.1	Confident	78.6	Confident	95 Å²	95	91.3 Å²	91.3	58%	0.576	55%	0.551	S	S	*	*	H	α-helix	trans	-62	-42.3	177	170.4	0	0	0	0	110.8	T217 E218 G225	T217-V221 WeakPolarHBondContact O-CB 3.22Å; T217-V221 WeakPolarHBondContact O-CG2 3.25Å; T217-V221 PolarHBondContact O-N 3.08Å; E218-V221 PolarHBondContact O-N 3.32Å; V221-G225 PolarHBondContact O-N 3.01Å
222	C	84.3	Confident	80	Confident	75 Å²	75	89.5 Å²	89.5	51%	0.507	54%	0.541	S	S	.	.	H	α-helix	trans	-65.8	-44.3	177.2	-162.8	0	0	0	0	112	E218 T219 V220 G225 L226	E218-C222 VanDerWaalsContact O-CB 3.28Å; E218-C222 WeakPolarHBondContact O-CB 3.18Å; E218-C222 PolarHBondContact O-N 3.2Å; T219-C222 PolarHBondContact O-N 3.19Å; V220-C222 VanDerWaalsContact C-N 3.33Å; V220-C222 PolarHBondContact O-N 3.03Å; C222-G225 PolarHBondContact O-N 3.14Å; C222-L226 WeakPolarHBondContact O-CB 3.37Å; C222-L226 WeakPolarHBondContact O-CG 3.4Å; C222-L226 PolarHBondContact O-N 3.35Å
223	A	86.9	Confident	81.6	Confident	58 Å²	58	89.3 Å²	89.3	48%	0.479	53%	0.532	S	S	.	.	H	α-helix	trans	-64.7	-40.7	177.5	0	0	0	0	0	112.4	T219 V220 L226 S227	T219-A223 VanDerWaalsContact O-CB 3.23Å; T219-A223 WeakPolarHBondContact O-CB 3.5Å; T219-A223 PolarHBondContact O-N 3.16Å; V220-A223 PolarHBondContact O-N 3.47Å; A223-L226 PolarHBondContact O-N 2.77Å; A223-S227 WeakPolarHBondContact O-CB 3.46Å; A223-S227 PolarHBondContact O-N 3Å; A223-S227 PolarHBondContact O-OG 2.8Å
224	L	90.3	Very high	83.4	Confident	104 Å²	104	86.9 Å²	86.9	55%	0.545	53%	0.525	S	S	.	.	H	α-helix	trans	-64.9	-43.1	173.2	-71.7	171.5	0	0	0	111	V220 L226 S227 V228	V220-L224 HydrophobicContact CG1-CD1 3.74Å; V220-L224 HydrophobicContact CG1-CG 4.33Å; V220-L224 WeakPolarHBondContact O-CB 3.28Å; V220-L224 VanDerWaalsContact O-CG 3.24Å; V220-L224 WeakPolarHBondContact O-CG 3.48Å; V220-L224 PolarHBondContact O-N 2.88Å; L224-L226 PolarHBondContact O-N 3.1Å; L224-S227 WeakPolarHBondContact CA-OG 3.49Å; L224-S227 PolarHBondContact O-N 3.02Å; L224-S227 PolarHBondContact O-OG 2.97Å; L224-V228 WeakPolarHBondContact O-CB 3.39Å; L224-V228 VanDerWaalsContact O-CG2 3.28Å; L224-V228 WeakPolarHBondContact O-CG2 3.46Å; L224-V228 PolarHBondContact O-N 3.48Å
225	G	90.3	Very high	84.9	Confident	45 Å²	45	87.1 Å²	87.1	46%	0.464	52%	0.523	S	S	.	.	H	α-helix	trans	-59.9	-44.8	174.6	0	0	0	0	0	113	V221 C222 G229	V221-G225 PolarHBondContact O-N 3.01Å; C222-G225 PolarHBondContact O-N 3.14Å; G225-G229 PolarHBondContact O-N 3.13Å
226	L	92.3	Very high	86.1	Confident	115 Å²	115	81 Å²	81	60%	0.602	50%	0.503	S	S	*	.	H	α-helix	trans	-65.3	-43.4	178	-76.3	170.8	0	0	0	112.5	C222 A223 L224 G229 L230	C222-L226 WeakPolarHBondContact O-CB 3.37Å; C222-L226 WeakPolarHBondContact O-CG 3.4Å; C222-L226 PolarHBondContact O-N 3.35Å; A223-L226 PolarHBondContact O-N 2.77Å; L224-L226 PolarHBondContact O-N 3.1Å; L226-G229 PolarHBondContact O-N 3.05Å; L226-L230 WeakPolarHBondContact O-CB 3.37Å; L226-L230 PolarHBondContact O-N 3.18Å
227	S	89.9	Confident	87.2	Confident	54 Å²	54	78.2 Å²	78.2	38%	0.378	49%	0.491	S	S	.	.	H	α-helix	trans	-64.8	-44.2	178.9	55.4	0	0	0	0	111.8	A223 L224 L230 V231	A223-S227 WeakPolarHBondContact O-CB 3.46Å; A223-S227 PolarHBondContact O-N 3Å; A223-S227 PolarHBondContact O-OG 2.8Å; L224-S227 WeakPolarHBondContact CA-OG 3.49Å; L224-S227 PolarHBondContact O-N 3.02Å; L224-S227 PolarHBondContact O-OG 2.97Å; S227-L230 PolarHBondContact O-N 3.06Å; S227-V231 VanDerWaalsContact O-CG2 3.31Å; S227-V231 WeakPolarHBondContact O-CG2 3.36Å; S227-V231 PolarHBondContact O-N 2.91Å
228	V	92.8	Very high	88	Confident	104 Å²	104	79.2 Å²	79.2	63%	0.63	49%	0.493	S	S	*	.	H	α-helix	trans	-62.8	-43	174.3	174.4	0	0	0	0	111.1	L224 V231 G232	L224-V228 WeakPolarHBondContact O-CB 3.39Å; L224-V228 VanDerWaalsContact O-CG2 3.28Å; L224-V228 WeakPolarHBondContact O-CG2 3.46Å; L224-V228 PolarHBondContact O-N 3.48Å; V228-V231 PolarHBondContact O-N 2.62Å; V228-G232 PolarHBondContact O-N 3.41Å
229	G	91.4	Very high	88.6	Confident	37 Å²	37	79.6 Å²	79.6	38%	0.381	49%	0.493	S	S	.	.	H	α-helix	trans	-60	-45.6	176.6	0	0	0	0	0	113.1	G225 L226 G232 I233	G225-G229 PolarHBondContact O-N 3.13Å; L226-G229 PolarHBondContact O-N 3.05Å; G229-G232 PolarHBondContact O-N 2.95Å; G229-I233 WeakPolarHBondContact O-CG1 3.28Å; G229-I233 PolarHBondContact O-N 3.34Å
230	L	92.8	Very high	88.9	Confident	113 Å²	113	80.9 Å²	80.9	59%	0.592	50%	0.496	S	S	*	.	H	α-helix	trans	-61.6	-45.3	176	-93.1	160.7	0	0	0	112.2	L226 S227 G232 I233 V234	L226-L230 WeakPolarHBondContact O-CB 3.37Å; L226-L230 PolarHBondContact O-N 3.18Å; S227-L230 PolarHBondContact O-N 3.06Å; L230-G232 VanDerWaalsContact C-N 3.31Å; L230-G232 PolarHBondContact O-N 3.01Å; L230-I233 PolarHBondContact O-N 2.99Å; L230-V234 WeakPolarHBondContact O-CG2 3.5Å; L230-V234 PolarHBondContact O-N 3.24Å
231	V	92.5	Very high	88.9	Confident	93 Å²	93	80.9 Å²	80.9	56%	0.564	49%	0.492	S	S	*	.	H	α-helix	trans	-60.9	-43	176	172.7	0	0	0	0	110.5	S227 V228 I233 V234 V235	S227-V231 VanDerWaalsContact O-CG2 3.31Å; S227-V231 WeakPolarHBondContact O-CG2 3.36Å; S227-V231 PolarHBondContact O-N 2.91Å; V228-V231 PolarHBondContact O-N 2.62Å; V231-I233 VanDerWaalsContact C-N 3.34Å; V231-I233 PolarHBondContact O-N 3.24Å; V231-V234 PolarHBondContact O-N 3.19Å; V231-V235 HydrophobicContact CG1-CG2 4.19Å; V231-V235 WeakPolarHBondContact O-CB 3.29Å; V231-V235 VanDerWaalsContact O-CG2 3.29Å; V231-V235 WeakPolarHBondContact O-CG2 3.22Å; V231-V235 PolarHBondContact O-N 3.3Å
232	G	91.4	Very high	88.3	Confident	44 Å²	44	81.6 Å²	81.6	45%	0.454	49%	0.489	S	S	.	.	H	α-helix	trans	-58.8	-42	176	0	0	0	0	0	113.2	V228 G229 L230 G236	V228-G232 PolarHBondContact O-N 3.41Å; G229-G232 PolarHBondContact O-N 2.95Å; L230-G232 VanDerWaalsContact C-N 3.31Å; L230-G232 PolarHBondContact O-N 3.01Å; G232-G236 PolarHBondContact O-N 3.32Å
233	I	93	Very high	87.7	Confident	111 Å²	111	80.3 Å²	80.3	57%	0.569	49%	0.488	S	S	*	.	H	α-helix	trans	-64.9	-46.5	176.3	-67.9	166.1	0	0	0	111	G229 L230 V231 G236 T237	G229-I233 WeakPolarHBondContact O-CG1 3.28Å; G229-I233 PolarHBondContact O-N 3.34Å; L230-I233 PolarHBondContact O-N 2.99Å; V231-I233 VanDerWaalsContact C-N 3.34Å; V231-I233 PolarHBondContact O-N 3.24Å; I233-G236 PolarHBondContact O-N 3.43Å; I233-T237 HydrophobicContact CG2-CG2 4.38Å; I233-T237 WeakPolarHBondContact O-CB 3.36Å; I233-T237 VanDerWaalsContact O-CG2 3.27Å; I233-T237 WeakPolarHBondContact O-CG2 3.15Å; I233-T237 PolarHBondContact O-N 2.84Å; I233-T237 PolarHBondContact O-OG1 2.96Å
234	V	91.4	Very high	86.8	Confident	81 Å²	81	83.8 Å²	83.8	49%	0.491	50%	0.498	S	S	.	.	H	α-helix	trans	-62.4	-47.5	179.6	173.5	0	0	0	0	110.7	L230 V231 T237 I238	L230-V234 WeakPolarHBondContact O-CG2 3.5Å; L230-V234 PolarHBondContact O-N 3.24Å; V231-V234 PolarHBondContact O-N 3.19Å; V234-T237 PolarHBondContact O-N 2.8Å; V234-T237 PolarHBondContact O-OG1 2.86Å; V234-I238 HydrophobicContact CG1-CD1 4.03Å; V234-I238 VanDerWaalsContact O-CG1 3.29Å; V234-I238 WeakPolarHBondContact O-CG1 3.4Å; V234-I238 PolarHBondContact O-N 3.27Å; V234-I238 VanDerWaalsContact O-N 3.07Å
235	V	89.9	Confident	85.5	Confident	65 Å²	65	88.5 Å²	88.5	39%	0.394	51%	0.509	S	S	.	.	H	α-helix	trans	-64.5	-44.9	178.9	173.2	0	0	0	0	110.8	V231 T237 I238 F239	V231-V235 HydrophobicContact CG1-CG2 4.19Å; V231-V235 WeakPolarHBondContact O-CB 3.29Å; V231-V235 VanDerWaalsContact O-CG2 3.29Å; V231-V235 WeakPolarHBondContact O-CG2 3.22Å; V231-V235 PolarHBondContact O-N 3.3Å; V235-T237 PolarHBondContact O-N 3.12Å; V235-I238 PolarHBondContact O-N 3.45Å; V235-F239 HydrophobicContact CG1-CD2 3.6Å; V235-F239 HydrophobicContact CG1-CE2 3.43Å; V235-F239 VanDerWaalsContact CG1-CE2 3.43Å; V235-F239 VanDerWaalsContact O-CD2 3.23Å; V235-F239 WeakPolarHBondContact O-CD2 3.43Å; V235-F239 PolarHBondContact O-N 3.29Å
236	G	89.1	Confident	83.8	Confident	29 Å²	29	91.5 Å²	91.5	30%	0.299	52%	0.522	S	S	.	.	H	α-helix	trans	-60.5	-43.5	177.8	0	0	0	0	0	112.9	G232 I233 I238 F239 I240	G232-G236 PolarHBondContact O-N 3.32Å; I233-G236 PolarHBondContact O-N 3.43Å; G236-I238 PolarHBondContact O-N 3.13Å; G236-F239 PolarHBondContact O-N 2.86Å; G236-I240 WeakPolarHBondContact O-CG1 3.43Å; G236-I240 PolarHBondContact O-N 3.21Å
237	T	88.1	Confident	82.1	Confident	66 Å²	66	89.5 Å²	89.5	41%	0.405	53%	0.529	S	S	.	.	H	α-helix	trans	-64.7	-39	176.2	53.1	0	0	0	0	112.2	I233 V234 V235 I240 I241	I233-T237 HydrophobicContact CG2-CG2 4.38Å; I233-T237 WeakPolarHBondContact O-CB 3.36Å; I233-T237 VanDerWaalsContact O-CG2 3.27Å; I233-T237 WeakPolarHBondContact O-CG2 3.15Å; I233-T237 PolarHBondContact O-N 2.84Å; I233-T237 PolarHBondContact O-OG1 2.96Å; V234-T237 PolarHBondContact O-N 2.8Å; V234-T237 PolarHBondContact O-OG1 2.86Å; V235-T237 PolarHBondContact O-N 3.12Å; T237-I240 PolarHBondContact O-N 3.42Å; T237-I241 WeakPolarHBondContact O-CB 3.43Å; T237-I241 VanDerWaalsContact O-CG1 3.25Å; T237-I241 WeakPolarHBondContact O-CG1 3.4Å; T237-I241 PolarHBondContact O-N 3.16Å
238	I	86	Confident	80.4	Confident	85 Å²	85	89.3 Å²	89.3	44%	0.436	54%	0.536	S	S	.	.	H	α-helix	trans	-61.3	-46.6	174	-69.1	167.8	0	0	0	111	V234 V235 G236 I240 I241 Q242	V234-I238 HydrophobicContact CG1-CD1 4.03Å; V234-I238 VanDerWaalsContact O-CG1 3.29Å; V234-I238 WeakPolarHBondContact O-CG1 3.4Å; V234-I238 PolarHBondContact O-N 3.27Å; V234-I238 VanDerWaalsContact O-N 3.07Å; V235-I238 PolarHBondContact O-N 3.45Å; G236-I238 PolarHBondContact O-N 3.13Å; I238-I240 PolarHBondContact O-N 3.33Å; I238-I241 PolarHBondContact O-N 2.95Å; I238-Q242 WeakPolarHBondContact O-CB 3.37Å; I238-Q242 PolarHBondContact O-N 3.42Å
239	F	84.2	Confident	78.3	Confident	136 Å²	136	91.3 Å²	91.3	60%	0.596	55%	0.548	S	S	*	.	H	α-helix	trans	-62.3	-40.5	177.4	-83.9	-67.6	0	0	0	112.4	V235 G236 Q242 G243	V235-F239 HydrophobicContact CG1-CD2 3.6Å; V235-F239 HydrophobicContact CG1-CE2 3.43Å; V235-F239 VanDerWaalsContact CG1-CE2 3.43Å; V235-F239 VanDerWaalsContact O-CD2 3.23Å; V235-F239 WeakPolarHBondContact O-CD2 3.43Å; V235-F239 PolarHBondContact O-N 3.29Å; G236-F239 PolarHBondContact O-N 2.86Å; F239-Q242 PolarHBondContact O-N 3.38Å; F239-G243 PolarHBondContact O-N 2.82Å
240	I	84.9	Confident	76.2	Confident	107 Å²	107	94.8 Å²	94.8	55%	0.549	57%	0.567	S	S	.	*	H	α-helix	trans	-63.4	-45.8	175	-69.4	169.5	0	0	0	110.6	G236 T237 I238 Q242 G243 L244	G236-I240 WeakPolarHBondContact O-CG1 3.43Å; G236-I240 PolarHBondContact O-N 3.21Å; T237-I240 PolarHBondContact O-N 3.42Å; I238-I240 PolarHBondContact O-N 3.33Å; I240-Q242 PolarHBondContact O-N 3.15Å; I240-G243 PolarHBondContact O-N 3.35Å; I240-L244 HydrophobicContact CG2-CD1 3.78Å; I240-L244 HydrophobicContact CG2-CG 4.34Å; I240-L244 WeakPolarHBondContact O-CB 3.44Å; I240-L244 VanDerWaalsContact O-CG 3.26Å; I240-L244 WeakPolarHBondContact O-CG 3.47Å; I240-L244 PolarHBondContact O-N 3.25Å
241	I	80.9	Confident	73.9	Confident	81 Å²	81	101.2 Å²	101.2	42%	0.415	58%	0.583	S	S	.	*	H	α-helix	trans	-64.1	-41.5	178.7	-68.6	166	0	0	0	111.1	T237 I238 L244 R245	T237-I241 WeakPolarHBondContact O-CB 3.43Å; T237-I241 VanDerWaalsContact O-CG1 3.25Å; T237-I241 WeakPolarHBondContact O-CG1 3.4Å; T237-I241 PolarHBondContact O-N 3.16Å; I238-I241 PolarHBondContact O-N 2.95Å; I241-L244 PolarHBondContact O-N 3.18Å; I241-R245 HydrophobicContact CG2-CG 4.45Å; I241-R245 WeakPolarHBondContact O-CB 3.47Å; I241-R245 VanDerWaalsContact O-CG 3.28Å; I241-R245 WeakPolarHBondContact O-CG 3.37Å; I241-R245 PolarHBondContact O-N 3.37Å
242	Q	72.3	Confident	71.9	Confident	111 Å²	111	105.4 Å²	105.4	52%	0.519	60%	0.596	S	S	.	*	H	α-helix	trans	-63.3	-44.7	174.1	-86.2	-179.1	-13.6	0	0	111.6	I238 F239 I240 L244 R245 S246	I238-Q242 WeakPolarHBondContact O-CB 3.37Å; I238-Q242 PolarHBondContact O-N 3.42Å; F239-Q242 PolarHBondContact O-N 3.38Å; I240-Q242 PolarHBondContact O-N 3.15Å; Q242-L244 VanDerWaalsContact C-N 3.34Å; Q242-L244 PolarHBondContact O-N 2.87Å; Q242-R245 PolarHBondContact O-N 3.29Å; Q242-S246 WeakPolarHBondContact O-CB 3.36Å; Q242-S246 PolarHBondContact O-N 3.19Å; Q242-S246 PolarHBondContact O-OG 3.36Å
243	G	71.6	Confident	70	Confident	47 Å²	47	109 Å²	109	49%	0.485	61%	0.611	S	S	.	*	H	α-helix	trans	-59.8	-41.5	175.5	0	0	0	0	0	113	F239 I240 S246 G247	F239-G243 PolarHBondContact O-N 2.82Å; I240-G243 PolarHBondContact O-N 3.35Å; G243-S246 PolarHBondContact O-N 3.22Å; G243-G247 PolarHBondContact O-N 2.73Å; G243-G247 VanDerWaalsContact O-N 3.12Å
244	L	68.2	Low	67.4	Low	132 Å²	132	107.2 Å²	107.2	69%	0.691	62%	0.621	S	S	*	*	H	α-helix	trans	-70.3	-32.7	176.8	-69.7	171	0	0	0	112.8	I240 I241 Q242	I240-L244 HydrophobicContact CG2-CD1 3.78Å; I240-L244 HydrophobicContact CG2-CG 4.34Å; I240-L244 WeakPolarHBondContact O-CB 3.44Å; I240-L244 VanDerWaalsContact O-CG 3.26Å; I240-L244 WeakPolarHBondContact O-CG 3.47Å; I240-L244 PolarHBondContact O-N 3.25Å; I241-L244 PolarHBondContact O-N 3.18Å; Q242-L244 VanDerWaalsContact C-N 3.34Å; Q242-L244 PolarHBondContact O-N 2.87Å
245	R	61.8	Low	65.9	Low	203 Å²	203	109 Å²	109	77%	0.766	63%	0.634	S	S	*	*	H	α-helix	trans	-74.7	-32	174.3	-74.1	177.4	179	-173.2	1.1	112.6	I241 Q242	I241-R245 HydrophobicContact CG2-CG 4.45Å; I241-R245 WeakPolarHBondContact O-CB 3.47Å; I241-R245 VanDerWaalsContact O-CG 3.28Å; I241-R245 WeakPolarHBondContact O-CG 3.37Å; I241-R245 PolarHBondContact O-N 3.37Å; Q242-R245 PolarHBondContact O-N 3.29Å
246	S	56.2	Low	63.3	Low	108 Å²	108	118 Å²	118	76%	0.755	68%	0.679	S	S	*	*	H	α-helix	trans	-80.3	-19.4	177.6	-66.8	0	0	0	0	114	Q242 G243 G248	Q242-S246 WeakPolarHBondContact O-CB 3.36Å; Q242-S246 PolarHBondContact O-N 3.19Å; Q242-S246 PolarHBondContact O-OG 3.36Å; G243-S246 PolarHBondContact O-N 3.22Å; S246-G248 VanDerWaalsContact C-N 3.32Å
247	G	55.1	Low	62	Low	72 Å²	72	122.5 Å²	122.5	74%	0.742	70%	0.698	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.3	0.9	175.7	0	0	0	0	0	115.4	G243	G243-G247 PolarHBondContact O-N 2.73Å; G243-G247 VanDerWaalsContact O-N 3.12Å
248	G	54.3	Low	60.7	Low	50 Å²	50	125.4 Å²	125.4	52%	0.515	71%	0.713	S	S	.	*			trans	-115	54.9	-167.5	0	0	0	0	0	115.3	S246	S246-G248 VanDerWaalsContact C-N 3.32Å
249	T	48.1	Very low	59.3	Low	146 Å²	146	127.7 Å²	127.7	90%	0.896	73%	0.729	S	S	*	*			trans	-175.3	100.7	147.4	13.4	0	0	0	0	112.3
250	S	47.6	Very low	57.8	Low	110 Å²	110	127.2 Å²	127.2	77%	0.769	74%	0.736	S	S	*	*			trans	-172.3	91.9	137.7	176.9	0	0	0	0	108.9
251	R	45.2	Very low	56.1	Low	248 Å²	248	128.4 Å²	128.4	94%	0.936	75%	0.748	S	S	*	*			trans	-121.5	98.4	153.3	-86.5	-172.8	179.5	168	0.7	106.6
252	H	51.1	Low	54.4	Low	181 Å²	181	131.6 Å²	131.6	84%	0.838	77%	0.77	S	S	*	*			trans	-72.8	128.3	157.8	-97.9	-44.8	0	0	0	108.7
253	P	51	Low	53.2	Low	119 Å²	119	133.1 Å²	133.1	77%	0.773	79%	0.788	S	S	*	*			trans	-90.6	119.9	156.1	29.8	-19.6	0	0	0	108.4
254	G	37.6	Very low	51.8	Low	75 Å²	75	139.7 Å²	139.7	77%	0.773	81%	0.812	S	S	*	*			trans	-127.3	124.5	164.3	0	0	0	0	0	109.2
255	P	60	Low	50.4	Low	118 Å²	118	140.3 Å²	140.3	77%	0.766	82%	0.822	S	S	*	*			trans	-103.3	134.3	152.4	32.2	-21.6	0	0	0	109.7
256	L	36.8	Very low	49.4	Very low	254 Å²	254	134.6 Å²	134.6	100%	1.33	83%	0.827	S	S	*	*				-153.6	0	109.9	-87.3	178.7	0	0	0	108.2

Retrieved 256 of 256 residues in 101.1 ms (Link to these results)

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