A0A077Z8Q3_TRITR Loading...

I-set domain containing protein

AlphaFold DB , UniProt , Accession A0A077Z8Q3, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 355 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	39	Very low	34.4	Very low	241 Å²	241	173 Å²	173	100%	1.187	82%	0.824	S	S	*	*				0	98.5	0	-71.5	176.8	-158.5	0	0	108.3
2	V	40.4	Very low	33.8	Very low	139 Å²	139	166.3 Å²	166.3	84%	0.842	82%	0.818	S	S	*	*			trans	-170.3	102	148.1	173.9	0	0	0	0	103.8
3	R	34.9	Very low	33.5	Very low	231 Å²	231	165.3 Å²	165.3	87%	0.872	82%	0.817	S	S	*	*			trans	-94.2	110.3	171.8	-85.4	-176.5	170.5	175.8	-2.3	106.9
4	L	33.1	Very low	33	Very low	145 Å²	145	158.4 Å²	158.4	76%	0.759	80%	0.8	S	S	*	*			trans	-101.3	99.4	169	-155	74.2	0	0	0	108.3	I6	L4-I6 HydrophobicContact CD2-CD1 4.03Å; L4-I6 HydrophobicContact CD2-CG1 4.43Å; L4-I6 HydrophobicContact CG-CG1 4.4Å
5	R	35.6	Very low	32.8	Very low	217 Å²	217	155.2 Å²	155.2	82%	0.819	80%	0.798	S	S	*	*			trans	-84	114.8	166.9	-80	-178.8	169.9	179.5	-4	107.4
6	I	42.5	Very low	32.5	Very low	129 Å²	129	157.1 Å²	157.1	66%	0.662	80%	0.799	S	S	*	*			trans	-108.8	100	164	-65.6	171.7	0	0	0	106.4	L4 L8	L4-I6 HydrophobicContact CD2-CD1 4.03Å; L4-I6 HydrophobicContact CD2-CG1 4.43Å; L4-I6 HydrophobicContact CG-CG1 4.4Å; I6-L8 HydrophobicContact CG2-CB 4.42Å; I6-L8 HydrophobicContact CG2-CD1 3.87Å
7	L	31.4	Very low	32.4	Very low	158 Å²	158	153.9 Å²	153.9	83%	0.827	79%	0.794	S	S	*	*			trans	-75.9	118.2	154.9	-104.7	87.6	0	0	0	106.5
8	L	33.3	Very low	32.8	Very low	136 Å²	136	152.1 Å²	152.1	71%	0.712	79%	0.791	S	S	*	*			trans	-147.5	109.6	157.1	-104.2	117.4	0	0	0	110.8	I6	I6-L8 HydrophobicContact CG2-CB 4.42Å; I6-L8 HydrophobicContact CG2-CD1 3.87Å
9	Y	30.2	Very low	33.2	Very low	198 Å²	198	147.7 Å²	147.7	78%	0.776	78%	0.779	S	S	*	*			trans	61.5	94.2	145.8	-73.3	-93.4	0	0	0	119.4	I11	Y9-I11 PolarHBondContact O-N 3.09Å; Y9-I11 VanDerWaalsContact O-N 3.16Å
10	L	25.7	Very low	34.1	Very low	176 Å²	176	146.1 Å²	146.1	92%	0.921	77%	0.767	S	S	*	*			trans	-40.1	106.6	135.4	-75.9	144.7	0	0	0	110.6
11	I	32.4	Very low	35.1	Very low	133 Å²	133	143.1 Å²	143.1	68%	0.682	76%	0.757	S	S	*	*			trans	-113	102.2	152.2	-62.1	178	0	0	0	105.3	Y9 L13	Y9-I11 PolarHBondContact O-N 3.09Å; Y9-I11 VanDerWaalsContact O-N 3.16Å; I11-L13 VanDerWaalsContact C-N 3.3Å; I11-L13 HydrophobicContact CG2-CG 4.31Å; I11-L13 PolarHBondContact O-N 2.97Å
12	A	26.9	Very low	36.5	Very low	92 Å²	92	132.3 Å²	132.3	76%	0.76	70%	0.704	S	S	*	*			trans	-63.8	93.9	165.8	0	0	0	0	0	108	A14	A12-A14 PolarHBondContact O-N 3.48Å
13	L	29.9	Very low	38.4	Very low	154 Å²	154	126 Å²	126	81%	0.806	67%	0.665	S	S	*	*			trans	-77.4	75.5	155.3	-70.7	172.9	0	0	0	106.8	I11 S15	I11-L13 VanDerWaalsContact C-N 3.3Å; I11-L13 HydrophobicContact CG2-CG 4.31Å; I11-L13 PolarHBondContact O-N 2.97Å; L13-S15 PolarHBondContact O-N 3.15Å
14	A	27.2	Very low	40.5	Very low	69 Å²	69	117.1 Å²	117.1	57%	0.57	63%	0.633	S	S	*	*			trans	-68.3	88.1	150.2	0	0	0	0	0	105.5	A12 F16	A12-A14 PolarHBondContact O-N 3.48Å; A14-F16 HydrophobicContact CB-CD2 4.02Å; A14-F16 HydrophobicContact CB-CE2 4.07Å; A14-F16 PolarHBondContact O-N 3.41Å
15	S	29.7	Very low	42.9	Very low	110 Å²	110	110.3 Å²	110.3	77%	0.769	60%	0.598	S	S	*	*			trans	-60.5	88.4	157	40.6	0	0	0	0	106.5	L13 S17	L13-S15 PolarHBondContact O-N 3.15Å; S15-S17 PolarHBondContact O-N 3.34Å
16	F	27.5	Very low	44.9	Very low	185 Å²	185	100.8 Å²	100.8	81%	0.811	56%	0.564	S	S	*	*			trans	-65.9	83.7	158.1	-87.3	-88.7	0	0	0	106.2	A14 V18	A14-F16 HydrophobicContact CB-CD2 4.02Å; A14-F16 HydrophobicContact CB-CE2 4.07Å; A14-F16 PolarHBondContact O-N 3.41Å; F16-V18 PolarHBondContact O-N 2.89Å
17	S	31.6	Very low	46.4	Very low	103 Å²	103	95.1 Å²	95.1	72%	0.72	54%	0.537	S	S	*	.			trans	-58.7	93.7	150.4	172	0	0	0	0	105.1	S15 A19	S15-S17 PolarHBondContact O-N 3.34Å; S17-A19 VanDerWaalsContact C-N 3.34Å; S17-A19 PolarHBondContact O-N 3.09Å
18	V	38.5	Very low	47.9	Very low	122 Å²	122	91.5 Å²	91.5	74%	0.739	53%	0.525	S	S	*	.			trans	-57.7	109.3	162.4	177.8	0	0	0	0	103.9	F16 E20	F16-V18 PolarHBondContact O-N 2.89Å; V18-E20 PolarHBondContact O-N 3.11Å
19	A	41.1	Very low	49.5	Very low	69 Å²	69	86.6 Å²	86.6	57%	0.57	50%	0.501	S	S	*	.			trans	-55.3	109.1	-179.1	0	0	0	0	0	108	S17 W120	S17-A19 VanDerWaalsContact C-N 3.34Å; S17-A19 PolarHBondContact O-N 3.09Å; A19-W120 HydrophobicContact CB-CH2 4.32Å
20	E	51.7	Low	50.9	Low	115 Å²	115	80.7 Å²	80.7	54%	0.537	48%	0.482	S	S	.	.			trans	-52.4	130.6	179.5	-66.8	172.1	168	0	0	108.5	V18 I22 K281	V18-E20 PolarHBondContact O-N 3.11Å; E20-I22 PolarHBondContact O-N 3.44Å; E20-I22 VanDerWaalsContact O-N 3.09Å; E20-K281 IonicContact OE1-NZ 3.85Å
21	P	54.3	Low	52.5	Low	84 Å²	84	72.5 Å²	72.5	55%	0.545	44%	0.44	S	S	.	.			trans	-62.8	118.4	178.8	25.1	-31.8	0	0	0	108.9	L23	P21-L23 PolarHBondContact O-N 3.11Å
22	I	69.3	Low	54.1	Low	14 Å²	14	66.3 Å²	66.3	7%	0.072	41%	0.409	C	S	.	.	S	Bend	trans	-61	-29.2	179.1	-63.8	-166.5	0	0	0	111	E20 V51 H52 K53 W120	E20-I22 PolarHBondContact O-N 3.44Å; E20-I22 VanDerWaalsContact O-N 3.09Å; I22-V51 HydrophobicContact CG2-CG1 4.16Å; I22-V51 CarbonylContact O-C 3.5Å; I22-V51 WeakPolarHBondContact O-CA 3.33Å; I22-H52 PolarHBondContact O-N 3.41Å; I22-K53 HydrophobicContact CD1-CD 3.84Å; I22-K53 HydrophobicContact CG1-CD 4.3Å; I22-K53 HydrophobicContact CG2-CB 4.33Å; I22-W120 HydrophobicContact CB-CB 4.27Å; I22-W120 HydrophobicContact CB-CD2 3.66Å; I22-W120 HydrophobicContact CB-CE3 4.04Å; I22-W120 HydrophobicContact CB-CG 3.73Å; I22-W120 HydrophobicContact CD1-CD2 3.82Å; I22-W120 HydrophobicContact CD1-CG 4.01Å; I22-W120 HydrophobicContact CD1-CZ2 3.68Å; I22-W120 HydrophobicContact CG1-CD2 3.58Å; I22-W120 VanDerWaalsContact CG1-CE2 3.45Å; I22-W120 HydrophobicContact CG1-CE3 4.01Å; I22-W120 HydrophobicContact CG1-CG 4.02Å; I22-W120 HydrophobicContact CG1-CH2 4.13Å; I22-W120 HydrophobicContact CG1-CZ2 3.74Å; I22-W120 HydrophobicContact CG1-CZ3 4.27Å; I22-W120 HydrophobicContact CG2-CG 4.41Å
23	L	78.8	Confident	56	Low	5 Å²	5	62.7 Å²	62.7	3%	0.026	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	138.9	-178.5	-61.4	-179.7	0	0	0	111	P21 V50 V51 F112 W120 V122	P21-L23 PolarHBondContact O-N 3.11Å; L23-V50 WeakPolarHBondContact CA-O 3.35Å; L23-V51 HydrophobicContact CD2-CG2 3.85Å; L23-F112 HydrophobicContact CD1-CB 3.8Å; L23-F112 HydrophobicContact CD2-CB 4.18Å; L23-F112 HydrophobicContact CG-CB 4.24Å; L23-W120 HydrophobicContact CD1-CB 3.96Å; L23-W120 WeakPolarHBondContact CD1-O 3.41Å; L23-W120 HydrophobicContact CG-CB 4.06Å; L23-V122 HydrophobicContact CB-CG2 3.82Å; L23-V122 WeakPolarHBondContact O-CG2 3.48Å
24	Q	80.1	Confident	58.1	Low	45 Å²	45	59.5 Å²	59.5	21%	0.21	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	141.9	167.8	-176.6	-173.3	-29.6	0	0	108.8	V26 C49 V50 H52	Q24-V26 HydrophobicContact CG-CG2 4.49Å; Q24-C49 CarbonylContact O-C 3.55Å; Q24-C49 WeakPolarHBondContact O-CA 3.27Å; Q24-V50 PolarHBondContact N-O 2.98Å; Q24-V50 PolarHBondContact O-N 2.93Å; Q24-H52 PolarHBondContact OE1-NE2 2.77Å
25	V	82.8	Confident	60.6	Low	3 Å²	3	58.9 Å²	58.9	2%	0.018	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	134.5	167.2	-177.8	0	0	0	0	110.3	F32 L47 L48 W65 C110 V122 V124	V25-F32 HydrophobicContact CB-CZ 4.08Å; V25-F32 HydrophobicContact CG1-CE2 3.91Å; V25-F32 HydrophobicContact CG1-CZ 3.74Å; V25-F32 WeakPolarHBondContact O-CE1 3.48Å; V25-F32 WeakPolarHBondContact O-CZ 3.34Å; V25-L47 HydrophobicContact CG1-CB 4.37Å; V25-L47 HydrophobicContact CG1-CD2 4.38Å; V25-L48 CarbonylContact C-O 3.52Å; V25-L48 VanDerWaalsContact CA-O 3.28Å; V25-L48 WeakPolarHBondContact CA-O 3.43Å; V25-W65 HydrophobicContact CB-CH2 4.32Å; V25-W65 HydrophobicContact CG1-CH2 3.74Å; V25-W65 HydrophobicContact CG1-CZ2 4.33Å; V25-W65 HydrophobicContact CG2-CH2 3.57Å; V25-W65 HydrophobicContact CG2-CZ2 4.32Å; V25-W65 HydrophobicContact CG2-CZ3 4.31Å; V25-C110 HydrophobicContact CG2-CB 4.37Å; V25-V122 HydrophobicContact CB-CG1 4.34Å; V25-V122 HydrophobicContact CG2-CB 4.01Å; V25-V122 HydrophobicContact CG2-CG1 3.71Å; V25-V124 HydrophobicContact CB-CG2 3.81Å; V25-V124 HydrophobicContact CG1-CG2 3.58Å; V25-V124 HydrophobicContact CG2-CG2 3.73Å
26	V	77.2	Confident	63	Low	17 Å²	17	54.2 Å²	54.2	10%	0.103	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	127.6	169.5	-175.6	0	0	0	0	108.2	Q24 L48 V50 Q90	Q24-V26 HydrophobicContact CG-CG2 4.49Å; V26-L48 HydrophobicContact CB-CB 4.4Å; V26-L48 PolarHBondContact N-O 3.01Å; V26-L48 PolarHBondContact O-N 2.96Å; V26-V50 HydrophobicContact CG2-CG2 3.95Å; V26-Q90 HydrophobicContact CG2-CG 4.42Å
27	G	75.3	Confident	65.8	Low	9 Å²	9	45.4 Å²	45.4	9%	0.093	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	148.4	169.2	0	0	0	0	0	111.2	V29 F32 V46	G27-V29 VanDerWaalsContact C-N 3.35Å; G27-F32 VanDerWaalsContact CA-CG 3.48Å; G27-V46 WeakPolarHBondContact CA-O 3.28Å
28	S	63.3	Low	68.1	Low	82 Å²	82	40.7 Å²	40.7	57%	0.573	24%	0.24	S	C	*	.	S	Bend	trans	-90.6	1.1	176.4	71.9	0	0	0	0	114	V46	S28-V46 PolarHBondContact N-O 3.37Å; S28-V46 VanDerWaalsContact N-O 3.09Å; S28-V46 WeakPolarHBondContact OG-CB 3.27Å
29	V	66.4	Low	70.1	Confident	34 Å²	34	35 Å²	35	21%	0.206	21%	0.206	C	C	.	.	S	Bend	trans	-104.1	146.1	-174	-64.6	0	0	0	0	110.2	G27 G31 F32 V37 I45	G27-V29 VanDerWaalsContact C-N 3.35Å; V29-G31 PolarHBondContact O-N 2.91Å; V29-G31 VanDerWaalsContact O-N 3.08Å; V29-F32 HydrophobicContact CG2-CB 4.22Å; V29-F32 WeakPolarHBondContact O-CB 3.45Å; V29-F32 PolarHBondContact O-N 2.99Å; V29-V37 HydrophobicContact CG2-CG1 3.94Å; V29-I45 HydrophobicContact CG1-CG2 4.31Å
30	D	59.8	Low	71.8	Confident	73 Å²	73	34.6 Å²	34.6	39%	0.39	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-23.2	-178.9	-61.6	-33.7	0	0	0	113	F32 H244 P245	D30-F32 PolarHBondContact O-N 3.28Å; D30-H244 PolarHBondContact O-CE1 2.93Å; D30-P245 HydrophobicContact CB-CB 4.3Å; D30-P245 WeakPolarHBondContact OD1-CB 3.33Å
31	G	58.8	Low	73.2	Confident	4 Å²	4	32.4 Å²	32.4	4%	0.041	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.1	0.6	172.6	0	0	0	0	0	115.1	V29 R33 Y38	V29-G31 PolarHBondContact O-N 2.91Å; V29-G31 VanDerWaalsContact O-N 3.08Å; G31-R33 PolarHBondContact O-N 3.16Å; G31-Y38 WeakPolarHBondContact O-CD2 3.46Å; G31-Y38 PolarHBondContact O-N 2.82Å
32	F	66.3	Low	74.6	Confident	4 Å²	4	33.6 Å²	33.6	2%	0.018	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	106.5	178.2	-171.5	-99.6	0	0	0	111.7	V25 G27 V29 D30 D36 V37 L47 V124	V25-F32 HydrophobicContact CB-CZ 4.08Å; V25-F32 HydrophobicContact CG1-CE2 3.91Å; V25-F32 HydrophobicContact CG1-CZ 3.74Å; V25-F32 WeakPolarHBondContact O-CE1 3.48Å; V25-F32 WeakPolarHBondContact O-CZ 3.34Å; G27-F32 VanDerWaalsContact CA-CG 3.48Å; V29-F32 HydrophobicContact CG2-CB 4.22Å; V29-F32 WeakPolarHBondContact O-CB 3.45Å; V29-F32 PolarHBondContact O-N 2.99Å; D30-F32 PolarHBondContact O-N 3.28Å; F32-D36 CarbonylContact C-O 3.55Å; F32-D36 VanDerWaalsContact CA-O 3.24Å; F32-D36 WeakPolarHBondContact CA-O 3.22Å; F32-V37 HydrophobicContact CD2-CG2 3.64Å; F32-V37 HydrophobicContact CE2-CG2 4.22Å; F32-L47 HydrophobicContact CD2-CD2 4.07Å; F32-L47 HydrophobicContact CE2-CD2 4.08Å; F32-V124 HydrophobicContact CE2-CG1 4.22Å
33	R	67.2	Low	75.4	Confident	16 Å²	16	35.8 Å²	35.8	6%	0.06	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146	130.1	-178.9	-72	-79.8	-165.2	-164.4	-4.2	110.2	G31 N35 D36 D167 G243	G31-R33 PolarHBondContact O-N 3.16Å; R33-N35 PolarHBondContact O-N 3.47Å; R33-N35 VanDerWaalsContact O-N 3.14Å; R33-D36 PolarHBondContact N-O 3.36Å; R33-D36 WeakPolarHBondContact O-CB 3.27Å; R33-D36 PolarHBondContact O-N 3.2Å; R33-D167 HydrophobicContact CB-CB 3.77Å; R33-D167 VanDerWaalsContact CD-CG 3.5Å; R33-D167 WeakPolarHBondContact CD-OD2 3.48Å; R33-D167 HydrophobicContact CG-CB 4.14Å; R33-D167 VanDerWaalsContact CG-OD1 3.31Å; R33-D167 WeakPolarHBondContact CG-OD1 3.3Å; R33-D167 IonicContact CZ-OD2 3.89Å; R33-D167 IonicContact NE-OD1 3.99Å; R33-D167 IonicContact NE-OD2 2.63Å; R33-D167 PolarHBondContact NE-OD2 2.02Å; R33-G243 PolarHBondContact NH2-O 3.47Å
34	N	72.6	Confident	75.8	Confident	86 Å²	86	42.3 Å²	42.3	46%	0.46	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	47.6	40.7	-179.6	-65.9	-33.1	0	0	0	114.4	D36 D167	N34-D36 PolarHBondContact O-N 3.1Å; N34-D167 VanDerWaalsContact CB-O 3.27Å; N34-D167 WeakPolarHBondContact CB-O 3.06Å; N34-D167 PolarHBondContact ND2-O 3.12Å
35	N	79.7	Confident	76.2	Confident	56 Å²	56	40.2 Å²	40.2	30%	0.299	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	66.7	12.6	-174.7	-51.9	-40.3	0	0	0	115.7	R33 T123 V124 K125	R33-N35 PolarHBondContact O-N 3.47Å; R33-N35 VanDerWaalsContact O-N 3.14Å; N35-T123 WeakPolarHBondContact CB-O 3.32Å; N35-V124 HydrophobicContact CB-CG2 4.48Å; N35-V124 CarbonylContact O-C 3.53Å; N35-V124 WeakPolarHBondContact O-CA 3.41Å; N35-V124 VanDerWaalsContact O-CG1 3.25Å; N35-V124 WeakPolarHBondContact O-CG1 3.45Å; N35-K125 PolarHBondContact O-N 3.39Å
36	D	81.9	Confident	76.5	Confident	13 Å²	13	42.1 Å²	42.1	7%	0.07	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	145.4	169.1	-72	-2.9	0	0	0	110	F32 R33 N34 Y38 K125 Y127 G168	F32-D36 CarbonylContact C-O 3.55Å; F32-D36 VanDerWaalsContact CA-O 3.24Å; F32-D36 WeakPolarHBondContact CA-O 3.22Å; R33-D36 PolarHBondContact N-O 3.36Å; R33-D36 WeakPolarHBondContact O-CB 3.27Å; R33-D36 PolarHBondContact O-N 3.2Å; N34-D36 PolarHBondContact O-N 3.1Å; D36-Y38 HydrophobicContact CB-CE1 4.44Å; D36-Y38 HydrophobicContact CB-CE2 4.17Å; D36-Y38 PolarHBondContact OD2-OH 3.49Å; D36-K125 CarbonylContact C-O 3.55Å; D36-K125 WeakPolarHBondContact CA-O 3.44Å; D36-Y127 HydrophobicContact CB-CD2 4.42Å; D36-Y127 HydrophobicContact CB-CE2 4.06Å; D36-Y127 WeakPolarHBondContact OD2-CE2 3.29Å; D36-G168 WeakPolarHBondContact OD2-CA 3.35Å
37	V	84.2	Confident	77.2	Confident	0 Å²	0	41.3 Å²	41.3	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	123.7	177.1	177.7	0	0	0	0	108.1	V29 F32 A39 I45 L47 V124 K125 V126 Y127	V29-V37 HydrophobicContact CG2-CG1 3.94Å; F32-V37 HydrophobicContact CD2-CG2 3.64Å; F32-V37 HydrophobicContact CE2-CG2 4.22Å; V37-A39 HydrophobicContact CG1-CB 4.42Å; V37-I45 HydrophobicContact CG1-CD1 4.18Å; V37-I45 HydrophobicContact CG1-CG2 3.97Å; V37-L47 HydrophobicContact CG2-CD2 3.67Å; V37-V124 HydrophobicContact CG2-CG1 3.66Å; V37-K125 PolarHBondContact N-O 3.44Å; V37-V126 HydrophobicContact CB-CB 4.48Å; V37-V126 HydrophobicContact CB-CG1 4.39Å; V37-V126 HydrophobicContact CB-CG2 4.17Å; V37-V126 HydrophobicContact CG1-CG1 4.29Å; V37-V126 HydrophobicContact CG2-CG2 4.45Å; V37-V126 WeakPolarHBondContact O-CA 3.46Å; V37-Y127 PolarHBondContact O-N 2.91Å
38	Y	80.3	Confident	77.9	Confident	4 Å²	4	42 Å²	42	2%	0.016	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	112.3	175.3	-52.3	-74.2	0	0	0	110.2	G31 D36 Y127 R129 G168 V197 M199 V210	G31-Y38 WeakPolarHBondContact O-CD2 3.46Å; G31-Y38 PolarHBondContact O-N 2.82Å; D36-Y38 HydrophobicContact CB-CE1 4.44Å; D36-Y38 HydrophobicContact CB-CE2 4.17Å; D36-Y38 PolarHBondContact OD2-OH 3.49Å; Y38-Y127 AromaticContact CD1-CD2 4Å; Y38-Y127 HydrophobicContact CD1-CD2 4Å; Y38-Y127 HydrophobicContact CD1-CG 4.22Å; Y38-Y127 AromaticContact CE1-CD2 3.67Å; Y38-Y127 HydrophobicContact CE1-CD2 3.67Å; Y38-Y127 HydrophobicContact CE1-CE2 4.25Å; Y38-Y127 HydrophobicContact CE1-CG 4.15Å; Y38-R129 PolarHBondContact O-NH2 2.87Å; Y38-G168 VanDerWaalsContact OH-CA 3.25Å; Y38-G168 WeakPolarHBondContact OH-CA 3.49Å; Y38-G168 PolarHBondContact OH-N 2.95Å; Y38-V197 HydrophobicContact CD2-CB 3.97Å; Y38-V197 HydrophobicContact CD2-CG1 3.46Å; Y38-V197 VanDerWaalsContact CD2-CG1 3.46Å; Y38-V197 HydrophobicContact CD2-CG2 4.39Å; Y38-V197 HydrophobicContact CE2-CB 4Å; Y38-V197 HydrophobicContact CE2-CG1 3.78Å; Y38-V197 HydrophobicContact CG-CG1 3.94Å; Y38-M199 HydrophobicContact CD1-SD 4.06Å; Y38-M199 HydrophobicContact CE1-CB 4.02Å; Y38-M199 HydrophobicContact CE1-CE 4.22Å; Y38-M199 HydrophobicContact CE1-CG 4.29Å; Y38-M199 HydrophobicContact CE1-SD 3.59Å; Y38-M199 VanDerWaalsContact CE1-SD 3.59Å; Y38-V210 HydrophobicContact CD1-CG2 4Å; Y38-V210 HydrophobicContact CG-CG1 4.46Å; Y38-V210 HydrophobicContact CG-CG2 4.32Å
39	A	80.3	Confident	79.2	Confident	2 Å²	2	38.1 Å²	38.1	2%	0.017	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	151.6	-174.5	0	0	0	0	0	111.5	V37 D43 I45 V102 Y127 T128 R129	V37-A39 HydrophobicContact CG1-CB 4.42Å; A39-D43 HydrophobicContact CB-CB 4.04Å; A39-I45 HydrophobicContact CB-CG2 3.88Å; A39-V102 HydrophobicContact CB-CB 4.43Å; A39-V102 HydrophobicContact CB-CG2 4.01Å; A39-Y127 PolarHBondContact N-O 2.94Å; A39-Y127 VanDerWaalsContact N-O 3.08Å; A39-Y127 VanDerWaalsContact O-O 3.11Å; A39-T128 VanDerWaalsContact O-CA 3.32Å; A39-T128 WeakPolarHBondContact O-CA 3.31Å; A39-R129 PolarHBondContact O-N 3.21Å; A39-R129 VanDerWaalsContact O-N 3.12Å
40	N	77.7	Confident	80.1	Confident	60 Å²	60	36.5 Å²	36.5	32%	0.321	19%	0.194	S	C	.	.			trans	-75.1	161.6	168.4	-56.5	-63.8	0	0	0	110.6	N42 D43 R129	N40-N42 PolarHBondContact O-N 3.26Å; N40-D43 VanDerWaalsContact CB-OD2 3.31Å; N40-D43 WeakPolarHBondContact CB-OD2 3.37Å; N40-D43 PolarHBondContact N-OD2 2.84Å; N40-D43 PolarHBondContact ND2-OD2 3.12Å; N40-D43 WeakPolarHBondContact O-CB 3.32Å; N40-D43 PolarHBondContact O-N 3.29Å; N40-D43 VanDerWaalsContact O-N 3.1Å; N40-R129 WeakPolarHBondContact OD1-CB 3.5Å; N40-R129 WeakPolarHBondContact OD1-CD 3.29Å
41	V	80.9	Confident	81.3	Confident	70 Å²	70	33 Å²	33	42%	0.424	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.8	130.1	169.4	-177.1	0	0	0	0	108.4	D43 T128	V41-D43 VanDerWaalsContact C-N 3.33Å; V41-T128 HydrophobicContact CG2-CG2 4.12Å
42	N	84.4	Confident	82.2	Confident	109 Å²	109	34.6 Å²	34.6	58%	0.583	18%	0.182	S	C	*	.	T	Hydrogen-bonded Turn	trans	76.3	3.9	-173.3	-47	-59.2	0	0	0	116.4	N40 T101 V102	N40-N42 PolarHBondContact O-N 3.26Å; N42-T101 HydrophobicContact CB-CG2 4.48Å; N42-V102 WeakPolarHBondContact CA-O 3.38Å; N42-V102 PolarHBondContact N-O 3.25Å
43	D	85.2	Confident	82.6	Confident	59 Å²	59	39.8 Å²	39.8	32%	0.316	20%	0.204	S	C	.	.			trans	-66	144.7	170.5	-79.3	-3.8	0	0	0	110.5	A39 N40 V41 T101 V102	A39-D43 HydrophobicContact CB-CB 4.04Å; N40-D43 VanDerWaalsContact CB-OD2 3.31Å; N40-D43 WeakPolarHBondContact CB-OD2 3.37Å; N40-D43 PolarHBondContact N-OD2 2.84Å; N40-D43 PolarHBondContact ND2-OD2 3.12Å; N40-D43 WeakPolarHBondContact O-CB 3.32Å; N40-D43 PolarHBondContact O-N 3.29Å; N40-D43 VanDerWaalsContact O-N 3.1Å; V41-D43 VanDerWaalsContact C-N 3.33Å; D43-T101 WeakPolarHBondContact O-CA 3.22Å; D43-V102 PolarHBondContact O-N 2.83Å
44	Q	87.6	Confident	82.8	Confident	142 Å²	142	43.7 Å²	43.7	66%	0.664	23%	0.234	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-90.1	125.4	171.2	-66.9	-171.7	-33.5	0	0	109.7	A100	Q44-A100 WeakPolarHBondContact CA-O 3.39Å
45	I	89	Confident	82.9	Confident	2 Å²	2	40.9 Å²	40.9	1%	0.01	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	147.8	176.1	65.2	168.2	0	0	0	110	V29 V37 A39 L47 N99 A100 V102 V126	V29-I45 HydrophobicContact CG1-CG2 4.31Å; V37-I45 HydrophobicContact CG1-CD1 4.18Å; V37-I45 HydrophobicContact CG1-CG2 3.97Å; A39-I45 HydrophobicContact CB-CG2 3.88Å; I45-L47 HydrophobicContact CD1-CD1 4.26Å; I45-L47 HydrophobicContact CD1-CG 4.42Å; I45-N99 WeakPolarHBondContact O-CA 3.02Å; I45-A100 HydrophobicContact CG1-CB 4.36Å; I45-A100 WeakPolarHBondContact CG1-O 3.39Å; I45-A100 PolarHBondContact N-O 3.37Å; I45-A100 PolarHBondContact O-N 3.06Å; I45-V102 HydrophobicContact CB-CG2 4.42Å; I45-V102 HydrophobicContact CD1-CG2 3.66Å; I45-V102 HydrophobicContact CG1-CG2 3.78Å; I45-V102 HydrophobicContact CG2-CG2 3.79Å; I45-V126 HydrophobicContact CD1-CG1 4.19Å; I45-V126 HydrophobicContact CD1-CG2 3.86Å
46	V	89.5	Confident	82.9	Confident	43 Å²	43	40.8 Å²	40.8	26%	0.261	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	123.9	169.9	-174.3	0	0	0	0	109	G27 S28 L48 L98 N99	G27-V46 WeakPolarHBondContact CA-O 3.28Å; S28-V46 PolarHBondContact N-O 3.37Å; S28-V46 VanDerWaalsContact N-O 3.09Å; S28-V46 WeakPolarHBondContact OG-CB 3.27Å; V46-L48 HydrophobicContact CG1-CD2 4.1Å; V46-L98 WeakPolarHBondContact CA-O 3.43Å; V46-N99 HydrophobicContact CG2-CB 4.38Å
47	L	90.7	Very high	82.9	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	134.2	174.3	-59.3	176.3	0	0	0	109.5	V25 F32 V37 I45 W65 S97 L98 L108 V124	V25-L47 HydrophobicContact CG1-CB 4.37Å; V25-L47 HydrophobicContact CG1-CD2 4.38Å; F32-L47 HydrophobicContact CD2-CD2 4.07Å; F32-L47 HydrophobicContact CE2-CD2 4.08Å; V37-L47 HydrophobicContact CG2-CD2 3.67Å; I45-L47 HydrophobicContact CD1-CD1 4.26Å; I45-L47 HydrophobicContact CD1-CG 4.42Å; L47-W65 HydrophobicContact CB-CH2 3.93Å; L47-W65 HydrophobicContact CB-CZ2 3.8Å; L47-W65 HydrophobicContact CD1-CH2 4.3Å; L47-S97 CarbonylContact O-C 3.54Å; L47-S97 WeakPolarHBondContact O-CA 3.41Å; L47-L98 HydrophobicContact CB-CB 4.36Å; L47-L98 HydrophobicContact CD1-CD2 4.33Å; L47-L98 PolarHBondContact N-O 2.9Å; L47-L98 PolarHBondContact O-N 3.26Å; L47-L108 HydrophobicContact CD1-CD1 3.97Å; L47-V124 HydrophobicContact CD1-CB 4.44Å; L47-V124 HydrophobicContact CD1-CG1 3.84Å; L47-V124 HydrophobicContact CD2-CG1 4.3Å
48	L	90	Very high	82.9	Confident	24 Å²	24	52.9 Å²	52.9	13%	0.126	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	117.7	179.5	-58.6	-176.7	0	0	0	108.7	V25 V26 V46 V50 T88 Q90 A95 S97	V25-L48 CarbonylContact C-O 3.52Å; V25-L48 VanDerWaalsContact CA-O 3.28Å; V25-L48 WeakPolarHBondContact CA-O 3.43Å; V26-L48 HydrophobicContact CB-CB 4.4Å; V26-L48 PolarHBondContact N-O 3.01Å; V26-L48 PolarHBondContact O-N 2.96Å; V46-L48 HydrophobicContact CG1-CD2 4.1Å; L48-V50 HydrophobicContact CB-CG2 4.35Å; L48-V50 PolarHBondContact O-N 2.93Å; L48-T88 HydrophobicContact CD2-CG2 3.71Å; L48-Q90 HydrophobicContact CD1-CB 4.44Å; L48-A95 HydrophobicContact CB-CB 4.26Å; L48-S97 VanDerWaalsContact CD2-CB 3.45Å
49	C	89.9	Confident	83	Confident	0 Å²	0	55.1 Å²	55.1	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	99.4	169.1	-173.3	0	0	0	0	109.7	Q24 W65 A95 W96 C110	Q24-C49 CarbonylContact O-C 3.55Å; Q24-C49 WeakPolarHBondContact O-CA 3.27Å; C49-W65 HydrophobicContact CB-CH2 4.47Å; C49-W65 HydrophobicContact CB-CZ2 3.68Å; C49-A95 CarbonylContact O-C 3.49Å; C49-A95 VanDerWaalsContact O-CA 3.26Å; C49-A95 WeakPolarHBondContact O-CA 3.33Å; C49-W96 HydrophobicContact CB-CB 4.47Å; C49-W96 PolarHBondContact N-O 2.99Å; C49-W96 PolarHBondContact O-N 3.47Å; C49-C110 HydrophobicContact CB-CB 3.63Å; C49-C110 WeakPolarHBondContact CB-SG 3.5Å; C49-C110 WeakPolarHBondContact SG-CB 3.31Å; C49-C110 CovalentContact SG-SG 2Å; C49-C110 PolarHBondContact SG-SG 3.3Å
50	V	86.5	Confident	83.2	Confident	0 Å²	0	56 Å²	56	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	134.1	-175.4	-168.3	0	0	0	0	109.9	L23 Q24 V26 L48 H52 Q90 W93 A95	L23-V50 WeakPolarHBondContact CA-O 3.35Å; Q24-V50 PolarHBondContact N-O 2.98Å; Q24-V50 PolarHBondContact O-N 2.93Å; V26-V50 HydrophobicContact CG2-CG2 3.95Å; L48-V50 HydrophobicContact CB-CG2 4.35Å; L48-V50 PolarHBondContact O-N 2.93Å; V50-H52 WeakPolarHBondContact CG1-NE2 3.27Å; V50-Q90 HydrophobicContact CG1-CB 4.15Å; V50-Q90 HydrophobicContact CG2-CB 3.7Å; V50-Q90 HydrophobicContact CG2-CG 3.79Å; V50-W93 HydrophobicContact CG1-CB 3.57Å; V50-W93 HydrophobicContact CG1-CG 4.4Å; V50-A95 HydrophobicContact CB-CB 4.49Å; V50-A95 HydrophobicContact CG2-CB 4.09Å
51	V	85.6	Confident	83.6	Confident	0 Å²	0	59 Å²	59	0%	0	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	105.7	177.7	-174.5	0	0	0	0	109.5	I22 L23 K53 L55 L60 V63 W93 P94	I22-V51 HydrophobicContact CG2-CG1 4.16Å; I22-V51 CarbonylContact O-C 3.5Å; I22-V51 WeakPolarHBondContact O-CA 3.33Å; L23-V51 HydrophobicContact CD2-CG2 3.85Å; V51-K53 HydrophobicContact CG1-CB 4.49Å; V51-K53 PolarHBondContact O-N 3.29Å; V51-K53 VanDerWaalsContact O-N 3.1Å; V51-L55 HydrophobicContact CG1-CD1 3.58Å; V51-L55 HydrophobicContact CG1-CG 3.89Å; V51-L60 HydrophobicContact CB-CD2 4.43Å; V51-L60 HydrophobicContact CG1-CD2 4.5Å; V51-L60 HydrophobicContact CG2-CD2 4.14Å; V51-V63 HydrophobicContact CG2-CG2 3.91Å; V51-W93 VanDerWaalsContact O-CE3 3.22Å; V51-P94 HydrophobicContact CB-CG 4.37Å; V51-P94 PolarHBondContact N-O 3.46Å
52	H	76.1	Confident	83.9	Confident	37 Å²	37	60.5 Å²	60.5	17%	0.171	31%	0.313	C	S	.	.			trans	-86.1	36.6	-180	-74.3	-77.1	0	0	0	113	I22 Q24 V50 W93	I22-H52 PolarHBondContact O-N 3.41Å; Q24-H52 PolarHBondContact OE1-NE2 2.77Å; V50-H52 WeakPolarHBondContact CG1-NE2 3.27Å; H52-W93 AromaticContact CE1-CD1 3.56Å; H52-W93 AromaticContact CE1-CG 3.98Å; H52-W93 AromaticContact CE1-NE1 3.91Å; H52-W93 AromaticContact ND1-CD1 3.48Å; H52-W93 AromaticContact ND1-CD2 3.87Å; H52-W93 AromaticContact ND1-CE2 3.75Å; H52-W93 AromaticContact ND1-CG 3.71Å; H52-W93 AromaticContact ND1-NE1 3.48Å; H52-W93 PolarHBondContact ND1-NE1 2.9Å
53	K	75.3	Confident	84.2	Confident	113 Å²	113	55.7 Å²	55.7	49%	0.491	29%	0.287	S	S	.	.	S	Bend	trans	-141.2	140	175.2	-166.6	170.9	-176.1	175.6	0	108.7	I22 V51 L55	I22-K53 HydrophobicContact CD1-CD 3.84Å; I22-K53 HydrophobicContact CG1-CD 4.3Å; I22-K53 HydrophobicContact CG2-CB 4.33Å; V51-K53 HydrophobicContact CG1-CB 4.49Å; V51-K53 PolarHBondContact O-N 3.29Å; V51-K53 VanDerWaalsContact O-N 3.1Å; K53-L55 HydrophobicContact CB-CD2 4.4Å; K53-L55 HydrophobicContact CB-CG 4.44Å; K53-L55 HydrophobicContact CD-CD2 4.22Å; K53-L55 HydrophobicContact CG-CD2 4.25Å; K53-L55 PolarHBondContact O-N 3.44Å
54	S	70.5	Confident	84.5	Confident	97 Å²	97	57.7 Å²	57.7	68%	0.678	29%	0.29	S	S	*	.			trans	-69.4	81.9	173.9	-179.4	0	0	0	0	109.8
55	L	76.3	Confident	84.8	Confident	27 Å²	27	50.9 Å²	50.9	14%	0.141	26%	0.259	C	S	.	.			trans	-85.9	145.9	171.7	-62.1	-171.9	0	0	0	110	V51 K53 E59 L60 F112	V51-L55 HydrophobicContact CG1-CD1 3.58Å; V51-L55 HydrophobicContact CG1-CG 3.89Å; K53-L55 HydrophobicContact CB-CD2 4.4Å; K53-L55 HydrophobicContact CB-CG 4.44Å; K53-L55 HydrophobicContact CD-CD2 4.22Å; K53-L55 HydrophobicContact CG-CD2 4.25Å; K53-L55 PolarHBondContact O-N 3.44Å; L55-E59 HydrophobicContact CB-CB 4.07Å; L55-L60 HydrophobicContact CB-CD2 4.04Å; L55-L60 HydrophobicContact CB-CG 4.34Å; L55-L60 HydrophobicContact CD1-CD2 4.32Å; L55-F112 HydrophobicContact CD1-CD2 3.94Å; L55-F112 HydrophobicContact CD1-CE1 4.44Å; L55-F112 HydrophobicContact CD1-CE2 3.35Å; L55-F112 HydrophobicContact CD1-CZ 3.65Å; L55-F112 HydrophobicContact CD2-CZ 4.38Å
56	S	79.6	Confident	85.1	Confident	54 Å²	54	50.9 Å²	50.9	38%	0.378	26%	0.259	S	S	.	.			trans	-67.4	153.5	171.9	65.6	0	0	0	0	110.8	P58 E59 L60	S56-P58 VanDerWaalsContact C-CD 3.41Å; S56-P58 VanDerWaalsContact C-N 3.28Å; S56-E59 WeakPolarHBondContact CB-OE2 3.46Å; S56-E59 PolarHBondContact N-OE2 2.76Å; S56-E59 WeakPolarHBondContact O-CA 3.27Å; S56-E59 WeakPolarHBondContact O-CB 3.44Å; S56-E59 PolarHBondContact O-N 2.91Å; S56-E59 VanDerWaalsContact OG-CD 3.26Å; S56-E59 WeakPolarHBondContact OG-CG 3.24Å; S56-E59 PolarHBondContact OG-OE2 2.92Å; S56-L60 PolarHBondContact O-N 3.4Å; S56-L60 VanDerWaalsContact O-N 3.11Å
57	K	80.4	Confident	85.2	Confident	181 Å²	181	49.1 Å²	49.1	79%	0.787	25%	0.248	S	C	*	.	H	α-helix	trans	-50.4	-41.3	176.2	-71	-175.9	179.6	-179.3	0	113.7	E59 L60	K57-E59 VanDerWaalsContact C-N 3.3Å; K57-E59 PolarHBondContact O-N 3.2Å; K57-L60 PolarHBondContact O-N 2.98Å
58	P	84.2	Confident	85.2	Confident	87 Å²	87	54.7 Å²	54.7	57%	0.565	27%	0.274	S	S	*	.	H	α-helix	trans	-62.4	-34.2	174.6	-24.1	35	0	0	0	113.9	S56 N61	S56-P58 VanDerWaalsContact C-CD 3.41Å; S56-P58 VanDerWaalsContact C-N 3.28Å; P58-N61 WeakPolarHBondContact O-CB 3.29Å; P58-N61 PolarHBondContact O-ND2 2.96Å
59	E	84.1	Confident	85.3	Confident	51 Å²	51	62.2 Å²	62.2	24%	0.238	30%	0.3	C	S	.	.	H	α-helix	trans	-73	-33.4	179.1	-72	172.1	134.7	0	0	112.2	L55 S56 K57 N61 Y62 F112 Q114	L55-E59 HydrophobicContact CB-CB 4.07Å; S56-E59 WeakPolarHBondContact CB-OE2 3.46Å; S56-E59 PolarHBondContact N-OE2 2.76Å; S56-E59 WeakPolarHBondContact O-CA 3.27Å; S56-E59 WeakPolarHBondContact O-CB 3.44Å; S56-E59 PolarHBondContact O-N 2.91Å; S56-E59 VanDerWaalsContact OG-CD 3.26Å; S56-E59 WeakPolarHBondContact OG-CG 3.24Å; S56-E59 PolarHBondContact OG-OE2 2.92Å; K57-E59 VanDerWaalsContact C-N 3.3Å; K57-E59 PolarHBondContact O-N 3.2Å; E59-N61 PolarHBondContact O-N 2.89Å; E59-N61 VanDerWaalsContact O-N 3.09Å; E59-Y62 WeakPolarHBondContact O-CB 3.32Å; E59-Y62 VanDerWaalsContact O-CD2 3.22Å; E59-Y62 WeakPolarHBondContact O-CD2 3.32Å; E59-Y62 PolarHBondContact O-N 3.26Å; E59-F112 WeakPolarHBondContact O-CE2 3.33Å; E59-Q114 PolarHBondContact OE1-NE2 2.79Å; E59-Q114 VanDerWaalsContact OE1-NE2 3.14Å
60	L	84.6	Confident	85.3	Confident	20 Å²	20	64 Å²	64	11%	0.105	32%	0.319	C	S	.	.	H	α-helix	trans	-56.6	-28	176.3	-70.5	176.4	0	0	0	112.6	V51 L55 S56 K57 Y62 V63 W87 P94	V51-L60 HydrophobicContact CB-CD2 4.43Å; V51-L60 HydrophobicContact CG1-CD2 4.5Å; V51-L60 HydrophobicContact CG2-CD2 4.14Å; L55-L60 HydrophobicContact CB-CD2 4.04Å; L55-L60 HydrophobicContact CB-CG 4.34Å; L55-L60 HydrophobicContact CD1-CD2 4.32Å; S56-L60 PolarHBondContact O-N 3.4Å; S56-L60 VanDerWaalsContact O-N 3.11Å; K57-L60 PolarHBondContact O-N 2.98Å; L60-Y62 PolarHBondContact O-N 3.43Å; L60-V63 WeakPolarHBondContact O-CB 3.47Å; L60-V63 WeakPolarHBondContact O-CG2 3.23Å; L60-V63 PolarHBondContact O-N 3.39Å; L60-W87 HydrophobicContact CB-CH2 3.66Å; L60-W87 HydrophobicContact CB-CZ2 3.67Å; L60-W87 HydrophobicContact CB-CZ3 4.4Å; L60-W87 HydrophobicContact CD1-CZ3 4.5Å; L60-W87 HydrophobicContact CD2-CH2 3.93Å; L60-W87 HydrophobicContact CD2-CZ3 4.13Å; L60-W87 HydrophobicContact CG-CH2 4.25Å; L60-W87 WeakPolarHBondContact O-CH2 3.4Å; L60-W87 WeakPolarHBondContact O-CZ2 3.32Å; L60-P94 HydrophobicContact CD1-CB 4.07Å; L60-P94 HydrophobicContact CD1-CG 4.25Å; L60-P94 HydrophobicContact CD2-CB 4.29Å; L60-P94 HydrophobicContact CD2-CG 3.99Å
61	N	84.5	Confident	85.5	Confident	122 Å²	122	66.3 Å²	66.3	65%	0.652	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	-13.2	176.5	-65.9	-31	0	0	0	114.7	P58 E59 V63	P58-N61 WeakPolarHBondContact O-CB 3.29Å; P58-N61 PolarHBondContact O-ND2 2.96Å; E59-N61 PolarHBondContact O-N 2.89Å; E59-N61 VanDerWaalsContact O-N 3.09Å; N61-V63 VanDerWaalsContact C-N 3.33Å
62	Y	87.8	Confident	85.8	Confident	103 Å²	103	66.9 Å²	66.9	40%	0.404	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.7	-3.8	176	-64.3	-67.9	0	0	0	113.8	E59 L60 F112 T113 Q114	E59-Y62 WeakPolarHBondContact O-CB 3.32Å; E59-Y62 VanDerWaalsContact O-CD2 3.22Å; E59-Y62 WeakPolarHBondContact O-CD2 3.32Å; E59-Y62 PolarHBondContact O-N 3.26Å; L60-Y62 PolarHBondContact O-N 3.43Å; Y62-F112 WeakPolarHBondContact O-CA 3.43Å; Y62-T113 WeakPolarHBondContact CB-O 3.12Å; Y62-T113 WeakPolarHBondContact CD1-O 3.23Å; Y62-T113 PolarHBondContact O-N 2.76Å; Y62-Q114 HydrophobicContact CD2-CB 4.32Å; Y62-Q114 HydrophobicContact CD2-CG 4.22Å; Y62-Q114 HydrophobicContact CE2-CG 4.07Å
63	V	90.4	Very high	86.6	Confident	8 Å²	8	65.4 Å²	65.4	5%	0.048	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	127.9	174.3	-175.2	0	0	0	0	109.9	V51 L60 N61 W87 W96 K111 F112	V51-V63 HydrophobicContact CG2-CG2 3.91Å; L60-V63 WeakPolarHBondContact O-CB 3.47Å; L60-V63 WeakPolarHBondContact O-CG2 3.23Å; L60-V63 PolarHBondContact O-N 3.39Å; N61-V63 VanDerWaalsContact C-N 3.33Å; V63-W87 HydrophobicContact CB-CH2 4Å; V63-W87 HydrophobicContact CB-CZ2 4.48Å; V63-W87 HydrophobicContact CG2-CH2 4.1Å; V63-W96 HydrophobicContact CG1-CB 3.74Å; V63-W96 HydrophobicContact CG1-CG 4.26Å; V63-K111 CarbonylContact C-O 3.51Å; V63-K111 VanDerWaalsContact CA-O 3.29Å; V63-K111 WeakPolarHBondContact CA-O 3.45Å; V63-F112 HydrophobicContact CG2-CB 4.43Å; V63-F112 HydrophobicContact CG2-CD2 3.79Å
64	R	92.4	Very high	87.3	Confident	100 Å²	100	61.8 Å²	61.8	38%	0.377	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	153.3	178.8	56.2	179.9	170.9	172.3	-1	112.3	V66 C110 K111	R64-V66 HydrophobicContact CG-CG1 4.12Å; R64-C110 CarbonylContact O-C 3.56Å; R64-C110 WeakPolarHBondContact O-CA 3.26Å; R64-K111 HydrophobicContact CG-CB 4.42Å; R64-K111 PolarHBondContact N-O 3.47Å; R64-K111 PolarHBondContact O-N 2.87Å
65	W	94.2	Very high	88.1	Confident	0 Å²	0	65.3 Å²	65.3	0%	0	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	129.1	167.8	-74.7	104.9	0	0	0	109.2	V25 L47 C49 V73 W96 L98 L108 C110 V124	V25-W65 HydrophobicContact CB-CH2 4.32Å; V25-W65 HydrophobicContact CG1-CH2 3.74Å; V25-W65 HydrophobicContact CG1-CZ2 4.33Å; V25-W65 HydrophobicContact CG2-CH2 3.57Å; V25-W65 HydrophobicContact CG2-CZ2 4.32Å; V25-W65 HydrophobicContact CG2-CZ3 4.31Å; L47-W65 HydrophobicContact CB-CH2 3.93Å; L47-W65 HydrophobicContact CB-CZ2 3.8Å; L47-W65 HydrophobicContact CD1-CH2 4.3Å; C49-W65 HydrophobicContact CB-CH2 4.47Å; C49-W65 HydrophobicContact CB-CZ2 3.68Å; W65-V73 HydrophobicContact CB-CG2 3.43Å; W65-V73 VanDerWaalsContact CB-CG2 3.43Å; W65-V73 PolarHBondContact O-N 3.35Å; W65-V73 VanDerWaalsContact O-N 3.1Å; W65-W96 AromaticContact CD1-CD1 3.46Å; W65-W96 VanDerWaalsContact CD1-CD1 3.46Å; W65-W96 AromaticContact CD1-NE1 3.99Å; W65-W96 AromaticContact NE1-CD1 3.91Å; W65-W96 PolarHBondContact NE1-O 2.96Å; W65-W96 VanDerWaalsContact NE1-O 3.09Å; W65-L98 HydrophobicContact CB-CD2 4.4Å; W65-L98 HydrophobicContact CD2-CB 4.29Å; W65-L98 HydrophobicContact CD2-CD2 4.01Å; W65-L98 HydrophobicContact CE3-CD2 4.31Å; W65-L98 HydrophobicContact CG-CB 4.13Å; W65-L98 HydrophobicContact CG-CD2 4.06Å; W65-L108 HydrophobicContact CE3-CB 4.04Å; W65-L108 HydrophobicContact CZ3-CB 4.13Å; W65-C110 HydrophobicContact CD2-CB 4.15Å; W65-C110 HydrophobicContact CE3-CB 3.94Å; W65-C110 HydrophobicContact CH2-CB 4Å; W65-C110 HydrophobicContact CZ2-CB 4.2Å; W65-C110 HydrophobicContact CZ3-CB 3.87Å; W65-V124 HydrophobicContact CH2-CG2 4.04Å; W65-V124 HydrophobicContact CZ3-CG2 4.04Å
66	V	93.5	Very high	88.6	Confident	1 Å²	1	68.6 Å²	68.6	1%	0.006	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	147	176.6	-58.2	0	0	0	0	112.2	R64 N71 L108 T109 K111	R64-V66 HydrophobicContact CG-CG1 4.12Å; V66-N71 WeakPolarHBondContact CA-O 3.37Å; V66-N71 WeakPolarHBondContact CB-O 3.37Å; V66-L108 CarbonylContact O-C 3.54Å; V66-L108 WeakPolarHBondContact O-CA 3.27Å; V66-T109 WeakPolarHBondContact CG2-O 3.11Å; V66-T109 PolarHBondContact N-O 2.75Å; V66-T109 PolarHBondContact O-N 2.96Å; V66-K111 HydrophobicContact CG2-CD 3.7Å; V66-K111 VanDerWaalsContact CG2-CE 3.48Å; V66-K111 HydrophobicContact CG2-CG 4.08Å
67	D	93.2	Very high	88.9	Confident	7 Å²	7	74.1 Å²	74.1	4%	0.037	35%	0.354	C	S	.	.			trans	-77.7	-177.1	172.1	73.1	0.3	0	0	0	111.9	R69 G70 N71 V73 I106	D67-R69 PolarHBondContact O-N 2.97Å; D67-R69 WeakPolarHBondContact OD1-CA 3.13Å; D67-R69 WeakPolarHBondContact OD1-CB 3.34Å; D67-R69 PolarHBondContact OD1-N 3.23Å; D67-G70 PolarHBondContact O-N 3.49Å; D67-G70 VanDerWaalsContact O-N 3.09Å; D67-G70 PolarHBondContact OD1-N 3.48Å; D67-N71 PolarHBondContact N-O 3.44Å; D67-N71 PolarHBondContact OD1-N 3.33Å; D67-N71 PolarHBondContact OD1-ND2 3.47Å; D67-N71 PolarHBondContact OD2-ND2 2.92Å; D67-V73 HydrophobicContact CB-CG1 4.04Å; D67-I106 HydrophobicContact CB-CD1 4.19Å
68	E	90.5	Very high	89.1	Confident	117 Å²	117	66 Å²	66	55%	0.547	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-23.3	175.8	-66	178	179.2	0	0	113.7	S107	E68-S107 WeakPolarHBondContact OE1-CB 3.49Å; E68-S107 PolarHBondContact OE1-N 3.48Å; E68-S107 PolarHBondContact OE1-OG 3.34Å
69	R	90.8	Very high	88.9	Confident	181 Å²	181	69 Å²	69	68%	0.683	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.2	-11.4	178.9	-52.5	-178	-139.2	-132.6	2.4	112.1	D67	D67-R69 PolarHBondContact O-N 2.97Å; D67-R69 WeakPolarHBondContact OD1-CA 3.13Å; D67-R69 WeakPolarHBondContact OD1-CB 3.34Å; D67-R69 PolarHBondContact OD1-N 3.23Å
70	G	89.7	Confident	88.7	Confident	37 Å²	37	68.4 Å²	68.4	38%	0.381	32%	0.324	S	S	.	.			trans	92.2	7.7	-179.3	0	0	0	0	0	115	D67	D67-G70 PolarHBondContact O-N 3.49Å; D67-G70 VanDerWaalsContact O-N 3.09Å; D67-G70 PolarHBondContact OD1-N 3.48Å
71	N	91.7	Very high	88.6	Confident	50 Å²	50	67.8 Å²	67.8	27%	0.267	32%	0.321	S	S	.	.			trans	-71.6	141.3	179	-55.3	-42.2	0	0	0	110.4	V66 D67 V73	V66-N71 WeakPolarHBondContact CA-O 3.37Å; V66-N71 WeakPolarHBondContact CB-O 3.37Å; D67-N71 PolarHBondContact N-O 3.44Å; D67-N71 PolarHBondContact OD1-N 3.33Å; D67-N71 PolarHBondContact OD1-ND2 3.47Å; D67-N71 PolarHBondContact OD2-ND2 2.92Å; N71-V73 PolarHBondContact O-N 2.93Å; N71-V73 VanDerWaalsContact O-N 3.16Å
72	D	91.7	Very high	88.5	Confident	12 Å²	12	68.6 Å²	68.6	6%	0.064	32%	0.32	C	S	.	.	B	Isolated β-bridge	trans	-76.5	102.3	176.5	-173.3	-25.6	0	0	0	109.7	C74 K75 E76	D72-C74 PolarHBondContact O-N 2.89Å; D72-C74 WeakPolarHBondContact OD1-CB 3.49Å; D72-C74 PolarHBondContact OD1-N 2.87Å; D72-C74 VanDerWaalsContact OD1-N 3.16Å; D72-K75 HydrophobicContact CB-CB 4.29Å; D72-K75 HydrophobicContact CB-CD 4.43Å; D72-K75 HydrophobicContact CB-CG 4.49Å; D72-K75 PolarHBondContact O-N 3.04Å; D72-K75 WeakPolarHBondContact OD2-CD 3.49Å; D72-K75 WeakPolarHBondContact OD2-CE 3.43Å; D72-K75 IonicContact OD2-NZ 2.97Å; D72-K75 PolarHBondContact OD2-NZ 3.35Å; D72-E76 PolarHBondContact N-OE1 3.37Å; D72-E76 WeakPolarHBondContact O-CB 3.48Å; D72-E76 PolarHBondContact O-N 3.38Å
73	V	92.8	Very high	88.5	Confident	5 Å²	5	65.2 Å²	65.2	3%	0.03	31%	0.312	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-16.9	-171.9	-49.4	0	0	0	0	113.2	W65 D67 N71 V78 S83 L98 L108	W65-V73 HydrophobicContact CB-CG2 3.43Å; W65-V73 VanDerWaalsContact CB-CG2 3.43Å; W65-V73 PolarHBondContact O-N 3.35Å; W65-V73 VanDerWaalsContact O-N 3.1Å; D67-V73 HydrophobicContact CB-CG1 4.04Å; N71-V73 PolarHBondContact O-N 2.93Å; N71-V73 VanDerWaalsContact O-N 3.16Å; V73-V78 HydrophobicContact CB-CG2 4.14Å; V73-V78 HydrophobicContact CG1-CG2 3.99Å; V73-S83 PolarHBondContact O-OG 3.11Å; V73-L98 HydrophobicContact CG2-CD1 3.69Å; V73-L98 HydrophobicContact CG2-CD2 4.31Å; V73-L108 HydrophobicContact CG1-CD2 3.9Å
74	C	90	Very high	88.6	Confident	37 Å²	37	74.5 Å²	74.5	25%	0.25	35%	0.346	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.5	-16.4	178.5	-56.6	0	0	0	0	113.1	D72 C85	D72-C74 PolarHBondContact O-N 2.89Å; D72-C74 WeakPolarHBondContact OD1-CB 3.49Å; D72-C74 PolarHBondContact OD1-N 2.87Å; D72-C74 VanDerWaalsContact OD1-N 3.16Å; C74-C85 HydrophobicContact CB-CB 3.62Å; C74-C85 WeakPolarHBondContact CB-SG 3.33Å; C74-C85 WeakPolarHBondContact SG-CB 3.5Å; C74-C85 CovalentContact SG-SG 2.01Å; C74-C85 PolarHBondContact SG-SG 3.44Å
75	K	88.4	Confident	88.6	Confident	171 Å²	171	71.3 Å²	71.3	74%	0.743	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-116.5	-29.9	-177.1	-64.1	-179	-172.9	131	0	112.5	D72	D72-K75 HydrophobicContact CB-CB 4.29Å; D72-K75 HydrophobicContact CB-CD 4.43Å; D72-K75 HydrophobicContact CB-CG 4.49Å; D72-K75 PolarHBondContact O-N 3.04Å; D72-K75 WeakPolarHBondContact OD2-CD 3.49Å; D72-K75 WeakPolarHBondContact OD2-CE 3.43Å; D72-K75 IonicContact OD2-NZ 2.97Å; D72-K75 PolarHBondContact OD2-NZ 3.35Å
76	E	86.6	Confident	88.6	Confident	96 Å²	96	73.7 Å²	73.7	45%	0.449	36%	0.358	S	S	.	.	S	Bend	trans	-108.6	148.4	-174.6	-61.9	176.1	-123.9	0	0	110.3	D72 V78	D72-E76 PolarHBondContact N-OE1 3.37Å; D72-E76 WeakPolarHBondContact O-CB 3.48Å; D72-E76 PolarHBondContact O-N 3.38Å; E76-V78 PolarHBondContact O-N 3.29Å
77	H	84.4	Confident	88.5	Confident	171 Å²	171	78.5 Å²	78.5	79%	0.792	38%	0.377	S	S	*	.			trans	-76.6	122.1	174.3	177.6	-75	0	0	0	110.2
78	V	84.6	Confident	88.4	Confident	9 Å²	9	81.3 Å²	81.3	6%	0.055	39%	0.394	C	S	.	.	B	Isolated β-bridge	trans	-109.8	129.8	176.4	-176.8	0	0	0	0	109	V73 E76 D80 L81 I106	V73-V78 HydrophobicContact CB-CG2 4.14Å; V73-V78 HydrophobicContact CG1-CG2 3.99Å; E76-V78 PolarHBondContact O-N 3.29Å; V78-D80 HydrophobicContact CG1-CB 4.43Å; V78-D80 PolarHBondContact O-N 3.35Å; V78-L81 HydrophobicContact CB-CB 4.49Å; V78-L81 HydrophobicContact CG1-CB 4.43Å; V78-L81 PolarHBondContact O-N 2.85Å; V78-I106 HydrophobicContact CG1-CD1 3.91Å
79	Q	81.6	Confident	88.1	Confident	150 Å²	150	82.5 Å²	82.5	70%	0.701	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.5	-31.9	-175.5	-71.1	-179.8	-23	0	0	113.3	L103	Q79-L103 WeakPolarHBondContact O-CD1 3.24Å
80	D	79.6	Confident	87.6	Confident	40 Å²	40	76.1 Å²	76.1	21%	0.214	38%	0.377	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.6	-9.4	-173.4	-55.1	-62.9	0	0	0	113.2	V78 L103 S104 I106	V78-D80 HydrophobicContact CG1-CB 4.43Å; V78-D80 PolarHBondContact O-N 3.35Å; D80-L103 WeakPolarHBondContact O-CB 3.26Å; D80-L103 PolarHBondContact O-N 3.11Å; D80-S104 VanDerWaalsContact CB-OG 3.27Å; D80-S104 WeakPolarHBondContact CB-OG 3.33Å; D80-S104 PolarHBondContact O-N 3.38Å; D80-S104 PolarHBondContact OD1-OG 3.24Å; D80-I106 HydrophobicContact CB-CB 4.29Å; D80-I106 HydrophobicContact CB-CD1 3.93Å
81	L	82	Confident	86.7	Confident	6 Å²	6	75.7 Å²	75.7	3%	0.031	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.7	126.1	-168.7	-165	79.1	0	0	0	112.2	V78 L98 A100 L108	V78-L81 HydrophobicContact CB-CB 4.49Å; V78-L81 HydrophobicContact CG1-CB 4.43Å; V78-L81 PolarHBondContact O-N 2.85Å; L81-L98 HydrophobicContact CD2-CD1 4.45Å; L81-L98 HydrophobicContact CD2-CD2 4.29Å; L81-A100 HydrophobicContact CD1-CB 3.44Å; L81-A100 VanDerWaalsContact CD1-CB 3.44Å; L81-A100 HydrophobicContact CD2-CB 3.71Å; L81-A100 HydrophobicContact CG-CB 3.57Å; L81-L108 HydrophobicContact CD2-CD1 4.19Å; L81-L108 HydrophobicContact CD2-CD2 4.11Å
82	Q	82.9	Confident	85.9	Confident	139 Å²	139	75.7 Å²	75.7	65%	0.65	38%	0.382	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.7	111.8	168.5	-156.9	-180	11.1	0	0	109.4	A100 T101	Q82-A100 CarbonylContact O-C 3.57Å; Q82-A100 WeakPolarHBondContact O-CA 3.49Å; Q82-T101 PolarHBondContact N-O 2.89Å; Q82-T101 PolarHBondContact O-N 3.31Å
83	S	87.6	Confident	85.4	Confident	32 Å²	32	76.7 Å²	76.7	22%	0.224	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	152.7	-162.9	112.4	0	0	0	0	114.9	V73 L98 N99	V73-S83 PolarHBondContact O-OG 3.11Å; S83-L98 WeakPolarHBondContact OG-CD1 3.24Å; S83-N99 CarbonylContact C-O 3.5Å; S83-N99 WeakPolarHBondContact CA-O 3.43Å
84	R	91.5	Very high	85.1	Confident	204 Å²	204	78 Å²	78	77%	0.77	39%	0.393	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-140.7	138.4	169.8	-64.3	-174.7	-178.6	-171.9	0.9	109.7	N99	R84-N99 PolarHBondContact N-O 2.85Å; R84-N99 PolarHBondContact O-N 2.81Å
85	C	93.7	Very high	85.1	Confident	32 Å²	32	76.2 Å²	76.2	22%	0.216	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	145.2	-177.4	-53.6	0	0	0	0	112.6	C74 W96 S97 L98	C74-C85 HydrophobicContact CB-CB 3.62Å; C74-C85 WeakPolarHBondContact CB-SG 3.33Å; C74-C85 WeakPolarHBondContact SG-CB 3.5Å; C74-C85 CovalentContact SG-SG 2.01Å; C74-C85 PolarHBondContact SG-SG 3.44Å; C85-W96 HydrophobicContact CB-CH2 4.29Å; C85-W96 HydrophobicContact CB-CZ2 3.58Å; C85-S97 WeakPolarHBondContact CA-O 3.46Å; C85-S97 WeakPolarHBondContact CB-O 3.35Å; C85-L98 VanDerWaalsContact SG-CD1 3.52Å
86	A	93.6	Very high	85.4	Confident	50 Å²	50	70.2 Å²	70.2	41%	0.413	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.4	154.2	178.3	0	0	0	0	0	111.7	W96 S97	A86-W96 VanDerWaalsContact C-CZ3 3.43Å; A86-S97 PolarHBondContact N-O 2.76Å; A86-S97 PolarHBondContact N-OG 3.09Å; A86-S97 WeakPolarHBondContact O-CB 2.81Å; A86-S97 PolarHBondContact O-N 2.68Å; A86-S97 PolarHBondContact O-OG 2.79Å
87	W	92.1	Very high	85.7	Confident	103 Å²	103	66.5 Å²	66.5	39%	0.39	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74	135.2	169.5	-78.4	109.9	0	0	0	110.3	L60 V63 P94 W96	L60-W87 HydrophobicContact CB-CH2 3.66Å; L60-W87 HydrophobicContact CB-CZ2 3.67Å; L60-W87 HydrophobicContact CB-CZ3 4.4Å; L60-W87 HydrophobicContact CD1-CZ3 4.5Å; L60-W87 HydrophobicContact CD2-CH2 3.93Å; L60-W87 HydrophobicContact CD2-CZ3 4.13Å; L60-W87 HydrophobicContact CG-CH2 4.25Å; L60-W87 WeakPolarHBondContact O-CH2 3.4Å; L60-W87 WeakPolarHBondContact O-CZ2 3.32Å; V63-W87 HydrophobicContact CB-CH2 4Å; V63-W87 HydrophobicContact CB-CZ2 4.48Å; V63-W87 HydrophobicContact CG2-CH2 4.1Å; W87-P94 HydrophobicContact CE3-CB 4.4Å; W87-P94 HydrophobicContact CZ3-CB 4.25Å; W87-W96 HydrophobicContact CB-CE3 4.33Å; W87-W96 HydrophobicContact CB-CZ3 4.27Å; W87-W96 AromaticContact CD1-CE3 3.69Å; W87-W96 AromaticContact CD1-CZ3 3.25Å; W87-W96 AromaticContact CD2-CE3 3.45Å; W87-W96 HydrophobicContact CD2-CE3 3.45Å; W87-W96 VanDerWaalsContact CD2-CE3 3.45Å; W87-W96 AromaticContact CD2-CZ3 3.89Å; W87-W96 HydrophobicContact CD2-CZ3 3.89Å; W87-W96 AromaticContact CE2-CE3 3.35Å; W87-W96 AromaticContact CE2-CZ3 3.68Å; W87-W96 HydrophobicContact CE3-CB 4.47Å; W87-W96 HydrophobicContact CE3-CE3 4.05Å; W87-W96 AromaticContact CG-CE3 3.6Å; W87-W96 HydrophobicContact CG-CE3 3.6Å; W87-W96 AromaticContact CG-CZ3 3.58Å; W87-W96 HydrophobicContact CG-CZ3 3.58Å; W87-W96 HydrophobicContact CH2-CB 4.09Å; W87-W96 HydrophobicContact CH2-CE3 4.39Å; W87-W96 HydrophobicContact CZ2-CD2 4.33Å; W87-W96 AromaticContact CZ2-CE3 3.83Å; W87-W96 HydrophobicContact CZ2-CE3 3.83Å; W87-W96 HydrophobicContact CZ2-CZ3 4.44Å; W87-W96 HydrophobicContact CZ3-CB 4.06Å; W87-W96 VanDerWaalsContact N-CZ3 3.33Å; W87-W96 AromaticContact NE1-CE3 3.52Å; W87-W96 AromaticContact NE1-CZ3 3.29Å; W87-W96 VanDerWaalsContact NE1-CZ3 3.29Å
88	T	90.3	Very high	86.1	Confident	65 Å²	65	58.3 Å²	58.3	40%	0.399	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	-172.1	173.6	-168.6	0	0	0	0	110	L48 A95	L48-T88 HydrophobicContact CD2-CG2 3.71Å; T88-A95 HydrophobicContact CG2-CB 3.96Å; T88-A95 PolarHBondContact N-O 2.75Å; T88-A95 PolarHBondContact O-N 2.89Å
89	Q	83.8	Confident	86.5	Confident	142 Å²	142	61.2 Å²	61.2	66%	0.664	32%	0.316	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-125.1	142	173.6	-67.9	-176	-14.2	0	0	111.4	W93	Q89-W93 CarbonylContact C-O 3.51Å; Q89-W93 VanDerWaalsContact CA-O 3.22Å; Q89-W93 WeakPolarHBondContact CA-O 2.98Å
90	Q	79.9	Confident	86.9	Confident	48 Å²	48	54.1 Å²	54.1	22%	0.224	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	113.4	172.7	-177.9	70	10	0	0	108.2	V26 L48 V50 G92 W93 A95	V26-Q90 HydrophobicContact CG2-CG 4.42Å; L48-Q90 HydrophobicContact CD1-CB 4.44Å; V50-Q90 HydrophobicContact CG1-CB 4.15Å; V50-Q90 HydrophobicContact CG2-CB 3.7Å; V50-Q90 HydrophobicContact CG2-CG 3.79Å; Q90-G92 PolarHBondContact O-N 2.96Å; Q90-W93 PolarHBondContact N-O 3.42Å; Q90-W93 WeakPolarHBondContact O-CB 3.21Å; Q90-W93 PolarHBondContact O-N 2.91Å; Q90-A95 HydrophobicContact CB-CB 4.23Å
91	A	72.6	Confident	87.5	Confident	27 Å²	27	53.4 Å²	53.4	22%	0.223	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	50	41.9	-176.8	0	0	0	0	0	113.6	W93	A91-W93 PolarHBondContact O-N 2.84Å
92	G	75.1	Confident	87.7	Confident	50 Å²	50	53.1 Å²	53.1	52%	0.515	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	82.6	-14	-178.3	0	0	0	0	0	115.2	Q90	Q90-G92 PolarHBondContact O-N 2.96Å
93	W	80.2	Confident	87.9	Confident	33 Å²	33	49.8 Å²	49.8	13%	0.125	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	142.2	177.4	-64.7	98.5	0	0	0	111.8	V50 V51 H52 Q89 Q90 A91	V50-W93 HydrophobicContact CG1-CB 3.57Å; V50-W93 HydrophobicContact CG1-CG 4.4Å; V51-W93 VanDerWaalsContact O-CE3 3.22Å; H52-W93 AromaticContact CE1-CD1 3.56Å; H52-W93 AromaticContact CE1-CG 3.98Å; H52-W93 AromaticContact CE1-NE1 3.91Å; H52-W93 AromaticContact ND1-CD1 3.48Å; H52-W93 AromaticContact ND1-CD2 3.87Å; H52-W93 AromaticContact ND1-CE2 3.75Å; H52-W93 AromaticContact ND1-CG 3.71Å; H52-W93 AromaticContact ND1-NE1 3.48Å; H52-W93 PolarHBondContact ND1-NE1 2.9Å; Q89-W93 CarbonylContact C-O 3.51Å; Q89-W93 VanDerWaalsContact CA-O 3.22Å; Q89-W93 WeakPolarHBondContact CA-O 2.98Å; Q90-W93 PolarHBondContact N-O 3.42Å; Q90-W93 WeakPolarHBondContact O-CB 3.21Å; Q90-W93 PolarHBondContact O-N 2.91Å; A91-W93 PolarHBondContact O-N 2.84Å
94	P	87.6	Confident	87.8	Confident	33 Å²	33	49.7 Å²	49.7	21%	0.214	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.5	136.5	174.4	27.8	-32.4	0	0	0	110.5	V51 L60 W87	V51-P94 HydrophobicContact CB-CG 4.37Å; V51-P94 PolarHBondContact N-O 3.46Å; L60-P94 HydrophobicContact CD1-CB 4.07Å; L60-P94 HydrophobicContact CD1-CG 4.25Å; L60-P94 HydrophobicContact CD2-CB 4.29Å; L60-P94 HydrophobicContact CD2-CG 3.99Å; W87-P94 HydrophobicContact CE3-CB 4.4Å; W87-P94 HydrophobicContact CZ3-CB 4.25Å
95	A	89.6	Confident	87.6	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	135.2	-180	0	0	0	0	0	111.8	L48 C49 V50 T88 Q90	L48-A95 HydrophobicContact CB-CB 4.26Å; C49-A95 CarbonylContact O-C 3.49Å; C49-A95 VanDerWaalsContact O-CA 3.26Å; C49-A95 WeakPolarHBondContact O-CA 3.33Å; V50-A95 HydrophobicContact CB-CB 4.49Å; V50-A95 HydrophobicContact CG2-CB 4.09Å; T88-A95 HydrophobicContact CG2-CB 3.96Å; T88-A95 PolarHBondContact N-O 2.75Å; T88-A95 PolarHBondContact O-N 2.89Å; Q90-A95 HydrophobicContact CB-CB 4.23Å
96	W	93.1	Very high	87.4	Confident	45 Å²	45	40.4 Å²	40.4	17%	0.17	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	105.5	173	-169.3	-120.6	0	0	0	109.6	C49 V63 W65 C85 A86 W87	C49-W96 HydrophobicContact CB-CB 4.47Å; C49-W96 PolarHBondContact N-O 2.99Å; C49-W96 PolarHBondContact O-N 3.47Å; V63-W96 HydrophobicContact CG1-CB 3.74Å; V63-W96 HydrophobicContact CG1-CG 4.26Å; W65-W96 AromaticContact CD1-CD1 3.46Å; W65-W96 VanDerWaalsContact CD1-CD1 3.46Å; W65-W96 AromaticContact CD1-NE1 3.99Å; W65-W96 AromaticContact NE1-CD1 3.91Å; W65-W96 PolarHBondContact NE1-O 2.96Å; W65-W96 VanDerWaalsContact NE1-O 3.09Å; C85-W96 HydrophobicContact CB-CH2 4.29Å; C85-W96 HydrophobicContact CB-CZ2 3.58Å; A86-W96 VanDerWaalsContact C-CZ3 3.43Å; W87-W96 HydrophobicContact CB-CE3 4.33Å; W87-W96 HydrophobicContact CB-CZ3 4.27Å; W87-W96 AromaticContact CD1-CE3 3.69Å; W87-W96 AromaticContact CD1-CZ3 3.25Å; W87-W96 AromaticContact CD2-CE3 3.45Å; W87-W96 HydrophobicContact CD2-CE3 3.45Å; W87-W96 VanDerWaalsContact CD2-CE3 3.45Å; W87-W96 AromaticContact CD2-CZ3 3.89Å; W87-W96 HydrophobicContact CD2-CZ3 3.89Å; W87-W96 AromaticContact CE2-CE3 3.35Å; W87-W96 AromaticContact CE2-CZ3 3.68Å; W87-W96 HydrophobicContact CE3-CB 4.47Å; W87-W96 HydrophobicContact CE3-CE3 4.05Å; W87-W96 AromaticContact CG-CE3 3.6Å; W87-W96 HydrophobicContact CG-CE3 3.6Å; W87-W96 AromaticContact CG-CZ3 3.58Å; W87-W96 HydrophobicContact CG-CZ3 3.58Å; W87-W96 HydrophobicContact CH2-CB 4.09Å; W87-W96 HydrophobicContact CH2-CE3 4.39Å; W87-W96 HydrophobicContact CZ2-CD2 4.33Å; W87-W96 AromaticContact CZ2-CE3 3.83Å; W87-W96 HydrophobicContact CZ2-CE3 3.83Å; W87-W96 HydrophobicContact CZ2-CZ3 4.44Å; W87-W96 HydrophobicContact CZ3-CB 4.06Å; W87-W96 VanDerWaalsContact N-CZ3 3.33Å; W87-W96 AromaticContact NE1-CE3 3.52Å; W87-W96 AromaticContact NE1-CZ3 3.29Å; W87-W96 VanDerWaalsContact NE1-CZ3 3.29Å
97	S	93.5	Very high	87.3	Confident	17 Å²	17	39.1 Å²	39.1	12%	0.119	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	146.7	-177.1	68	0	0	0	0	112.1	L47 L48 C85 A86	L47-S97 CarbonylContact O-C 3.54Å; L47-S97 WeakPolarHBondContact O-CA 3.41Å; L48-S97 VanDerWaalsContact CD2-CB 3.45Å; C85-S97 WeakPolarHBondContact CA-O 3.46Å; C85-S97 WeakPolarHBondContact CB-O 3.35Å; A86-S97 PolarHBondContact N-O 2.76Å; A86-S97 PolarHBondContact N-OG 3.09Å; A86-S97 WeakPolarHBondContact O-CB 2.81Å; A86-S97 PolarHBondContact O-N 2.68Å; A86-S97 PolarHBondContact O-OG 2.79Å
98	L	93.7	Very high	87.3	Confident	0 Å²	0	34.2 Å²	34.2	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	104.4	168.4	176.6	70	0	0	0	107.1	V46 L47 W65 V73 L81 S83 C85 A100 L108	V46-L98 WeakPolarHBondContact CA-O 3.43Å; L47-L98 HydrophobicContact CB-CB 4.36Å; L47-L98 HydrophobicContact CD1-CD2 4.33Å; L47-L98 PolarHBondContact N-O 2.9Å; L47-L98 PolarHBondContact O-N 3.26Å; W65-L98 HydrophobicContact CB-CD2 4.4Å; W65-L98 HydrophobicContact CD2-CB 4.29Å; W65-L98 HydrophobicContact CD2-CD2 4.01Å; W65-L98 HydrophobicContact CE3-CD2 4.31Å; W65-L98 HydrophobicContact CG-CB 4.13Å; W65-L98 HydrophobicContact CG-CD2 4.06Å; V73-L98 HydrophobicContact CG2-CD1 3.69Å; V73-L98 HydrophobicContact CG2-CD2 4.31Å; L81-L98 HydrophobicContact CD2-CD1 4.45Å; L81-L98 HydrophobicContact CD2-CD2 4.29Å; S83-L98 WeakPolarHBondContact OG-CD1 3.24Å; C85-L98 VanDerWaalsContact SG-CD1 3.52Å; L98-A100 HydrophobicContact CG-CB 4.28Å; L98-L108 HydrophobicContact CD2-CD1 3.66Å
99	N	92.1	Very high	87.5	Confident	70 Å²	70	31.9 Å²	31.9	37%	0.374	18%	0.184	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	120.5	168.8	-176.4	-10.3	0	0	0	107.7	I45 V46 S83 R84	I45-N99 WeakPolarHBondContact O-CA 3.02Å; V46-N99 HydrophobicContact CG2-CB 4.38Å; S83-N99 CarbonylContact C-O 3.5Å; S83-N99 WeakPolarHBondContact CA-O 3.43Å; R84-N99 PolarHBondContact N-O 2.85Å; R84-N99 PolarHBondContact O-N 2.81Å
100	A	91.1	Very high	87.9	Confident	1 Å²	1	25.1 Å²	25.1	1%	0.008	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	146.5	-172.3	0	0	0	0	0	114.3	Q44 I45 L81 Q82 L98	Q44-A100 WeakPolarHBondContact CA-O 3.39Å; I45-A100 HydrophobicContact CG1-CB 4.36Å; I45-A100 WeakPolarHBondContact CG1-O 3.39Å; I45-A100 PolarHBondContact N-O 3.37Å; I45-A100 PolarHBondContact O-N 3.06Å; L81-A100 HydrophobicContact CD1-CB 3.44Å; L81-A100 VanDerWaalsContact CD1-CB 3.44Å; L81-A100 HydrophobicContact CD2-CB 3.71Å; L81-A100 HydrophobicContact CG-CB 3.57Å; Q82-A100 CarbonylContact O-C 3.57Å; Q82-A100 WeakPolarHBondContact O-CA 3.49Å; L98-A100 HydrophobicContact CG-CB 4.28Å
101	T	90.7	Very high	88.4	Confident	25 Å²	25	25.8 Å²	25.8	15%	0.153	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	123.3	169.9	-53.5	0	0	0	0	109.4	N42 D43 Q82 L103	N42-T101 HydrophobicContact CB-CG2 4.48Å; D43-T101 WeakPolarHBondContact O-CA 3.22Å; Q82-T101 PolarHBondContact N-O 2.89Å; Q82-T101 PolarHBondContact O-N 3.31Å; T101-L103 HydrophobicContact CG2-CD2 4.36Å
102	V	87.6	Confident	89.2	Confident	0 Å²	0	24.8 Å²	24.8	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	121.5	-177.1	-177.5	0	0	0	0	110.4	A39 N42 D43 I45 V126 T128	A39-V102 HydrophobicContact CB-CB 4.43Å; A39-V102 HydrophobicContact CB-CG2 4.01Å; N42-V102 WeakPolarHBondContact CA-O 3.38Å; N42-V102 PolarHBondContact N-O 3.25Å; D43-V102 PolarHBondContact O-N 2.83Å; I45-V102 HydrophobicContact CB-CG2 4.42Å; I45-V102 HydrophobicContact CD1-CG2 3.66Å; I45-V102 HydrophobicContact CG1-CG2 3.78Å; I45-V102 HydrophobicContact CG2-CG2 3.79Å; V102-V126 HydrophobicContact CB-CG1 4.4Å; V102-V126 HydrophobicContact CG1-CG1 3.66Å; V102-V126 HydrophobicContact CG2-CG1 3.76Å; V102-T128 HydrophobicContact CG1-CG2 3.83Å
103	L	87.2	Confident	89.5	Confident	68 Å²	68	25.2 Å²	25.2	36%	0.356	14%	0.138	S	C	.	.			trans	-108.7	-33.1	178	-55.8	175.5	0	0	0	112.2	Q79 D80 T101	Q79-L103 WeakPolarHBondContact O-CD1 3.24Å; D80-L103 WeakPolarHBondContact O-CB 3.26Å; D80-L103 PolarHBondContact O-N 3.11Å; T101-L103 HydrophobicContact CG2-CD2 4.36Å
104	S	84.7	Confident	89.3	Confident	30 Å²	30	25.6 Å²	25.6	21%	0.21	14%	0.141	C	C	.	.	S	Bend	trans	-150	167	177	91.8	0	0	0	0	110.6	D80 I106	D80-S104 VanDerWaalsContact CB-OG 3.27Å; D80-S104 WeakPolarHBondContact CB-OG 3.33Å; D80-S104 PolarHBondContact O-N 3.38Å; D80-S104 PolarHBondContact OD1-OG 3.24Å; S104-I106 PolarHBondContact O-N 3.4Å
105	P	86.9	Confident	88.3	Confident	32 Å²	32	33.4 Å²	33.4	21%	0.208	18%	0.175	C	C	.	.			trans	-60.7	130.1	173.6	-21.5	32.5	0	0	0	111.7	V126 T128	P105-V126 CarbonylContact C-O 3.55Å; P105-V126 WeakPolarHBondContact CA-O 3.23Å; P105-T128 WeakPolarHBondContact CD-OG1 3.47Å; P105-T128 HydrophobicContact CG-CG2 4.07Å; P105-T128 VanDerWaalsContact CG-OG1 3.25Å; P105-T128 WeakPolarHBondContact CG-OG1 3.36Å
106	I	89.9	Confident	86.9	Confident	9 Å²	9	44.5 Å²	44.5	5%	0.046	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	141.9	-176	-177.3	162.2	0	0	0	111.4	D67 V78 D80 S104 L108 V126	D67-I106 HydrophobicContact CB-CD1 4.19Å; V78-I106 HydrophobicContact CG1-CD1 3.91Å; D80-I106 HydrophobicContact CB-CB 4.29Å; D80-I106 HydrophobicContact CB-CD1 3.93Å; S104-I106 PolarHBondContact O-N 3.4Å; I106-L108 HydrophobicContact CD1-CD2 4.05Å; I106-L108 HydrophobicContact CG1-CD2 4.22Å; I106-L108 HydrophobicContact CG1-CG 4.38Å; I106-L108 HydrophobicContact CG2-CG 4.38Å; I106-V126 HydrophobicContact CG2-CB 3.95Å; I106-V126 HydrophobicContact CG2-CG2 4.16Å; I106-V126 PolarHBondContact N-O 2.87Å; I106-V126 PolarHBondContact O-N 2.86Å
107	S	91.3	Very high	85.4	Confident	24 Å²	24	48.2 Å²	48.2	17%	0.168	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	129.2	166	-43.4	0	0	0	0	111	E68 V124	E68-S107 WeakPolarHBondContact OE1-CB 3.49Å; E68-S107 PolarHBondContact OE1-N 3.48Å; E68-S107 PolarHBondContact OE1-OG 3.34Å; S107-V124 CarbonylContact C-O 3.57Å; S107-V124 WeakPolarHBondContact CA-O 3.47Å
108	L	93.1	Very high	84	Confident	0 Å²	0	56.1 Å²	56.1	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	129.5	-179.5	-65.1	167.8	0	0	0	109.1	L47 W65 V66 V73 L81 L98 I106 T123 V124 V126	L47-L108 HydrophobicContact CD1-CD1 3.97Å; W65-L108 HydrophobicContact CE3-CB 4.04Å; W65-L108 HydrophobicContact CZ3-CB 4.13Å; V66-L108 CarbonylContact O-C 3.54Å; V66-L108 WeakPolarHBondContact O-CA 3.27Å; V73-L108 HydrophobicContact CG1-CD2 3.9Å; L81-L108 HydrophobicContact CD2-CD1 4.19Å; L81-L108 HydrophobicContact CD2-CD2 4.11Å; L98-L108 HydrophobicContact CD2-CD1 3.66Å; I106-L108 HydrophobicContact CD1-CD2 4.05Å; I106-L108 HydrophobicContact CG1-CD2 4.22Å; I106-L108 HydrophobicContact CG1-CG 4.38Å; I106-L108 HydrophobicContact CG2-CG 4.38Å; L108-T123 CarbonylContact O-C 3.52Å; L108-T123 WeakPolarHBondContact O-CA 3.26Å; L108-V124 PolarHBondContact N-O 2.84Å; L108-V124 PolarHBondContact O-N 2.92Å; L108-V126 HydrophobicContact CD1-CG2 4.04Å
109	T	93.2	Very high	83	Confident	15 Å²	15	58.1 Å²	58.1	9%	0.092	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	118.8	178.7	-54.8	0	0	0	0	109.8	V66 K111 N121 V122 T123	V66-T109 WeakPolarHBondContact CG2-O 3.11Å; V66-T109 PolarHBondContact N-O 2.75Å; V66-T109 PolarHBondContact O-N 2.96Å; T109-K111 HydrophobicContact CG2-CD 4.3Å; T109-K111 HydrophobicContact CG2-CG 3.68Å; T109-N121 HydrophobicContact CG2-CB 3.81Å; T109-V122 CarbonylContact C-O 3.56Å; T109-V122 WeakPolarHBondContact CA-O 3.19Å; T109-T123 WeakPolarHBondContact CG2-OG1 3.42Å; T109-T123 PolarHBondContact OG1-OG1 2.82Å
110	C	92.8	Very high	82.6	Confident	0 Å²	0	58.9 Å²	58.9	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	128.5	163.1	-176.9	0	0	0	0	108.8	V25 C49 R64 W65 N121 V122	V25-C110 HydrophobicContact CG2-CB 4.37Å; C49-C110 HydrophobicContact CB-CB 3.63Å; C49-C110 WeakPolarHBondContact CB-SG 3.5Å; C49-C110 WeakPolarHBondContact SG-CB 3.31Å; C49-C110 CovalentContact SG-SG 2Å; C49-C110 PolarHBondContact SG-SG 3.3Å; R64-C110 CarbonylContact O-C 3.56Å; R64-C110 WeakPolarHBondContact O-CA 3.26Å; W65-C110 HydrophobicContact CD2-CB 4.15Å; W65-C110 HydrophobicContact CE3-CB 3.94Å; W65-C110 HydrophobicContact CH2-CB 4Å; W65-C110 HydrophobicContact CZ2-CB 4.2Å; W65-C110 HydrophobicContact CZ3-CB 3.87Å; C110-N121 CarbonylContact O-C 3.55Å; C110-N121 WeakPolarHBondContact O-CA 3.43Å; C110-V122 PolarHBondContact N-O 3.49Å; C110-V122 PolarHBondContact O-N 3.09Å
111	K	90.7	Very high	82.6	Confident	63 Å²	63	63.7 Å²	63.7	27%	0.274	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	138.4	178.6	-61.8	-172.9	177.9	173.1	0	110.3	V63 R64 V66 T109 W120 N121	V63-K111 CarbonylContact C-O 3.51Å; V63-K111 VanDerWaalsContact CA-O 3.29Å; V63-K111 WeakPolarHBondContact CA-O 3.45Å; R64-K111 HydrophobicContact CG-CB 4.42Å; R64-K111 PolarHBondContact N-O 3.47Å; R64-K111 PolarHBondContact O-N 2.87Å; V66-K111 HydrophobicContact CG2-CD 3.7Å; V66-K111 VanDerWaalsContact CG2-CE 3.48Å; V66-K111 HydrophobicContact CG2-CG 4.08Å; T109-K111 HydrophobicContact CG2-CD 4.3Å; T109-K111 HydrophobicContact CG2-CG 3.68Å; K111-W120 CarbonylContact C-O 3.24Å; K111-W120 WeakPolarHBondContact CA-O 3.45Å; K111-N121 HydrophobicContact CG-CB 3.93Å
112	F	88.8	Confident	82.4	Confident	6 Å²	6	63.7 Å²	63.7	3%	0.026	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	115.2	163	172.8	-100.1	0	0	0	107.7	L23 L55 E59 Y62 V63 Q114 G119 W120	L23-F112 HydrophobicContact CD1-CB 3.8Å; L23-F112 HydrophobicContact CD2-CB 4.18Å; L23-F112 HydrophobicContact CG-CB 4.24Å; L55-F112 HydrophobicContact CD1-CD2 3.94Å; L55-F112 HydrophobicContact CD1-CE1 4.44Å; L55-F112 HydrophobicContact CD1-CE2 3.35Å; L55-F112 HydrophobicContact CD1-CZ 3.65Å; L55-F112 HydrophobicContact CD2-CZ 4.38Å; E59-F112 WeakPolarHBondContact O-CE2 3.33Å; Y62-F112 WeakPolarHBondContact O-CA 3.43Å; V63-F112 HydrophobicContact CG2-CB 4.43Å; V63-F112 HydrophobicContact CG2-CD2 3.79Å; F112-Q114 HydrophobicContact CE1-CB 4.34Å; F112-Q114 HydrophobicContact CZ-CB 4.25Å; F112-G119 CarbonylContact O-C 3.45Å; F112-G119 WeakPolarHBondContact O-CA 3.47Å; F112-W120 HydrophobicContact CB-CB 4.4Å; F112-W120 PolarHBondContact N-O 2.81Å; F112-W120 PolarHBondContact O-N 2.86Å
113	T	82.1	Confident	82.5	Confident	59 Å²	59	66.5 Å²	66.5	36%	0.362	33%	0.332	S	S	.	.			trans	-132	104	-176	-48.5	0	0	0	0	111.2	Y62	Y62-T113 WeakPolarHBondContact CB-O 3.12Å; Y62-T113 WeakPolarHBondContact CD1-O 3.23Å; Y62-T113 PolarHBondContact O-N 2.76Å
114	Q	75.9	Confident	82.7	Confident	40 Å²	40	63.3 Å²	63.3	19%	0.187	32%	0.315	C	S	.	.			trans	-105.6	138.8	172.8	-168.3	-178.8	33.3	0	0	108.9	E59 Y62 F112 R116 H117	E59-Q114 PolarHBondContact OE1-NE2 2.79Å; E59-Q114 VanDerWaalsContact OE1-NE2 3.14Å; Y62-Q114 HydrophobicContact CD2-CB 4.32Å; Y62-Q114 HydrophobicContact CD2-CG 4.22Å; Y62-Q114 HydrophobicContact CE2-CG 4.07Å; F112-Q114 HydrophobicContact CE1-CB 4.34Å; F112-Q114 HydrophobicContact CZ-CB 4.25Å; Q114-R116 PolarHBondContact O-N 2.66Å; Q114-H117 PolarHBondContact O-N 2.62Å; Q114-H117 VanDerWaalsContact O-N 3.1Å; Q114-H117 PolarHBondContact OE1-CD2 2.91Å; Q114-H117 VanDerWaalsContact OE1-CD2 3.23Å
115	Q	66.2	Low	82.8	Confident	197 Å²	197	66.3 Å²	66.3	92%	0.921	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.3	-18.5	-172.5	-72.4	-165.9	-16.1	0	0	115.8
116	R	60.8	Low	82.9	Confident	234 Å²	234	64.9 Å²	64.9	88%	0.883	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.9	-8.9	-176.6	-72.3	-173.1	-178.9	-175.7	0.6	115.5	Q114	Q114-R116 PolarHBondContact O-N 2.66Å
117	H	60.6	Low	82.6	Confident	123 Å²	123	65.5 Å²	65.5	57%	0.569	32%	0.317	S	S	*	.	S	Bend	trans	-121.5	144.2	-175.5	-75.6	-77.7	0	0	0	111	Q114 G119	Q114-H117 PolarHBondContact O-N 2.62Å; Q114-H117 VanDerWaalsContact O-N 3.1Å; Q114-H117 PolarHBondContact OE1-CD2 2.91Å; Q114-H117 VanDerWaalsContact OE1-CD2 3.23Å; H117-G119 PolarHBondContact O-N 2.67Å; H117-G119 VanDerWaalsContact O-N 3.11Å
118	E	63.7	Low	82	Confident	183 Å²	183	65.2 Å²	65.2	86%	0.855	31%	0.314	S	S	*	.	P	Polyproline II helix	trans	-50.6	120.5	163.7	-76.2	-175.9	158.3	0	0	108.2	W120	E118-W120 PolarHBondContact O-NE1 2.78Å
119	G	74.4	Confident	81.2	Confident	41 Å²	41	67 Å²	67	42%	0.423	32%	0.321	S	S	.	.	P	Polyproline II helix	trans	-70.4	141.1	-174.9	0	0	0	0	0	110.8	F112 H117	F112-G119 CarbonylContact O-C 3.45Å; F112-G119 WeakPolarHBondContact O-CA 3.47Å; H117-G119 PolarHBondContact O-N 2.67Å; H117-G119 VanDerWaalsContact O-N 3.11Å
120	W	83.8	Confident	80.2	Confident	86 Å²	86	67.4 Å²	67.4	33%	0.326	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	139.3	176.6	-62.8	72.5	0	0	0	108.5	A19 I22 L23 K111 F112 E118	A19-W120 HydrophobicContact CB-CH2 4.32Å; I22-W120 HydrophobicContact CB-CB 4.27Å; I22-W120 HydrophobicContact CB-CD2 3.66Å; I22-W120 HydrophobicContact CB-CE3 4.04Å; I22-W120 HydrophobicContact CB-CG 3.73Å; I22-W120 HydrophobicContact CD1-CD2 3.82Å; I22-W120 HydrophobicContact CD1-CG 4.01Å; I22-W120 HydrophobicContact CD1-CZ2 3.68Å; I22-W120 HydrophobicContact CG1-CD2 3.58Å; I22-W120 VanDerWaalsContact CG1-CE2 3.45Å; I22-W120 HydrophobicContact CG1-CE3 4.01Å; I22-W120 HydrophobicContact CG1-CG 4.02Å; I22-W120 HydrophobicContact CG1-CH2 4.13Å; I22-W120 HydrophobicContact CG1-CZ2 3.74Å; I22-W120 HydrophobicContact CG1-CZ3 4.27Å; I22-W120 HydrophobicContact CG2-CG 4.41Å; L23-W120 HydrophobicContact CD1-CB 3.96Å; L23-W120 WeakPolarHBondContact CD1-O 3.41Å; L23-W120 HydrophobicContact CG-CB 4.06Å; K111-W120 CarbonylContact C-O 3.24Å; K111-W120 WeakPolarHBondContact CA-O 3.45Å; F112-W120 HydrophobicContact CB-CB 4.4Å; F112-W120 PolarHBondContact N-O 2.81Å; F112-W120 PolarHBondContact O-N 2.86Å; E118-W120 PolarHBondContact O-NE1 2.78Å
121	N	89.4	Confident	78.8	Confident	103 Å²	103	73 Å²	73	55%	0.551	36%	0.358	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-140.4	149.1	177.1	63.1	21.4	0	0	0	111.7	T109 C110 K111	T109-N121 HydrophobicContact CG2-CB 3.81Å; C110-N121 CarbonylContact O-C 3.55Å; C110-N121 WeakPolarHBondContact O-CA 3.43Å; K111-N121 HydrophobicContact CG-CB 3.93Å
122	V	87.5	Confident	77.5	Confident	24 Å²	24	75.1 Å²	75.1	15%	0.145	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	123.5	172	-178.5	0	0	0	0	107.3	L23 V25 T109 C110	L23-V122 HydrophobicContact CB-CG2 3.82Å; L23-V122 WeakPolarHBondContact O-CG2 3.48Å; V25-V122 HydrophobicContact CB-CG1 4.34Å; V25-V122 HydrophobicContact CG2-CB 4.01Å; V25-V122 HydrophobicContact CG2-CG1 3.71Å; T109-V122 CarbonylContact C-O 3.56Å; T109-V122 WeakPolarHBondContact CA-O 3.19Å; C110-V122 PolarHBondContact N-O 3.49Å; C110-V122 PolarHBondContact O-N 3.09Å
123	T	90.3	Very high	76	Confident	60 Å²	60	79.6 Å²	79.6	37%	0.368	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	137.5	180	-57.9	0	0	0	0	110.5	N35 L108 T109	N35-T123 WeakPolarHBondContact CB-O 3.32Å; L108-T123 CarbonylContact O-C 3.52Å; L108-T123 WeakPolarHBondContact O-CA 3.26Å; T109-T123 WeakPolarHBondContact CG2-OG1 3.42Å; T109-T123 PolarHBondContact OG1-OG1 2.82Å
124	V	89.8	Confident	74.7	Confident	0 Å²	0	85.7 Å²	85.7	0%	0	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	135.7	177.3	178.8	0	0	0	0	108.1	V25 F32 N35 V37 L47 W65 S107 L108	V25-V124 HydrophobicContact CB-CG2 3.81Å; V25-V124 HydrophobicContact CG1-CG2 3.58Å; V25-V124 HydrophobicContact CG2-CG2 3.73Å; F32-V124 HydrophobicContact CE2-CG1 4.22Å; N35-V124 HydrophobicContact CB-CG2 4.48Å; N35-V124 CarbonylContact O-C 3.53Å; N35-V124 WeakPolarHBondContact O-CA 3.41Å; N35-V124 VanDerWaalsContact O-CG1 3.25Å; N35-V124 WeakPolarHBondContact O-CG1 3.45Å; V37-V124 HydrophobicContact CG2-CG1 3.66Å; L47-V124 HydrophobicContact CD1-CB 4.44Å; L47-V124 HydrophobicContact CD1-CG1 3.84Å; L47-V124 HydrophobicContact CD2-CG1 4.3Å; W65-V124 HydrophobicContact CH2-CG2 4.04Å; W65-V124 HydrophobicContact CZ3-CG2 4.04Å; S107-V124 CarbonylContact C-O 3.57Å; S107-V124 WeakPolarHBondContact CA-O 3.47Å; L108-V124 PolarHBondContact N-O 2.84Å; L108-V124 PolarHBondContact O-N 2.92Å
125	K	88.3	Confident	74.1	Confident	94 Å²	94	91.7 Å²	91.7	41%	0.409	45%	0.447	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	125.5	174.8	-64.7	178.9	-175.9	169.2	0	110.2	N35 D36 V37 Y127	N35-K125 PolarHBondContact O-N 3.39Å; D36-K125 CarbonylContact C-O 3.55Å; D36-K125 WeakPolarHBondContact CA-O 3.44Å; V37-K125 PolarHBondContact N-O 3.44Å; K125-Y127 HydrophobicContact CB-CD2 4.31Å; K125-Y127 HydrophobicContact CB-CE2 3.58Å; K125-Y127 HydrophobicContact CD-CE2 4.38Å; K125-Y127 WeakPolarHBondContact CD-OH 3.38Å
126	V	88	Confident	74.2	Confident	2 Å²	2	83.6 Å²	83.6	1%	0.012	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	122	173.9	-172.6	0	0	0	0	108.3	V37 I45 V102 P105 I106 L108	V37-V126 HydrophobicContact CB-CB 4.48Å; V37-V126 HydrophobicContact CB-CG1 4.39Å; V37-V126 HydrophobicContact CB-CG2 4.17Å; V37-V126 HydrophobicContact CG1-CG1 4.29Å; V37-V126 HydrophobicContact CG2-CG2 4.45Å; V37-V126 WeakPolarHBondContact O-CA 3.46Å; I45-V126 HydrophobicContact CD1-CG1 4.19Å; I45-V126 HydrophobicContact CD1-CG2 3.86Å; V102-V126 HydrophobicContact CB-CG1 4.4Å; V102-V126 HydrophobicContact CG1-CG1 3.66Å; V102-V126 HydrophobicContact CG2-CG1 3.76Å; P105-V126 CarbonylContact C-O 3.55Å; P105-V126 WeakPolarHBondContact CA-O 3.23Å; I106-V126 HydrophobicContact CG2-CB 3.95Å; I106-V126 HydrophobicContact CG2-CG2 4.16Å; I106-V126 PolarHBondContact N-O 2.87Å; I106-V126 PolarHBondContact O-N 2.86Å; L108-V126 HydrophobicContact CD1-CG2 4.04Å
127	Y	83.8	Confident	75.3	Confident	21 Å²	21	75.1 Å²	75.1	8%	0.082	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	138.9	176.9	-65.3	-88.1	0	0	0	109.8	D36 V37 Y38 A39 K125 M199	D36-Y127 HydrophobicContact CB-CD2 4.42Å; D36-Y127 HydrophobicContact CB-CE2 4.06Å; D36-Y127 WeakPolarHBondContact OD2-CE2 3.29Å; V37-Y127 PolarHBondContact O-N 2.91Å; Y38-Y127 AromaticContact CD1-CD2 4Å; Y38-Y127 HydrophobicContact CD1-CD2 4Å; Y38-Y127 HydrophobicContact CD1-CG 4.22Å; Y38-Y127 AromaticContact CE1-CD2 3.67Å; Y38-Y127 HydrophobicContact CE1-CD2 3.67Å; Y38-Y127 HydrophobicContact CE1-CE2 4.25Å; Y38-Y127 HydrophobicContact CE1-CG 4.15Å; A39-Y127 PolarHBondContact N-O 2.94Å; A39-Y127 VanDerWaalsContact N-O 3.08Å; A39-Y127 VanDerWaalsContact O-O 3.11Å; K125-Y127 HydrophobicContact CB-CD2 4.31Å; K125-Y127 HydrophobicContact CB-CE2 3.58Å; K125-Y127 HydrophobicContact CD-CE2 4.38Å; K125-Y127 WeakPolarHBondContact CD-OH 3.38Å; Y127-M199 HydrophobicContact CD1-CE 4.13Å; Y127-M199 HydrophobicContact CD1-SD 3.67Å; Y127-M199 HydrophobicContact CD2-SD 4.33Å; Y127-M199 HydrophobicContact CE1-CE 3.87Å; Y127-M199 HydrophobicContact CE1-SD 4.05Å; Y127-M199 HydrophobicContact CE2-CE 4.49Å; Y127-M199 HydrophobicContact CG-SD 3.81Å
128	T	78.8	Confident	76.5	Confident	19 Å²	19	72.4 Å²	72.4	12%	0.117	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	139.1	170.5	60.8	0	0	0	0	111.3	A39 V41 V102 P105 S208	A39-T128 VanDerWaalsContact O-CA 3.32Å; A39-T128 WeakPolarHBondContact O-CA 3.31Å; V41-T128 HydrophobicContact CG2-CG2 4.12Å; V102-T128 HydrophobicContact CG1-CG2 3.83Å; P105-T128 WeakPolarHBondContact CD-OG1 3.47Å; P105-T128 HydrophobicContact CG-CG2 4.07Å; P105-T128 VanDerWaalsContact CG-OG1 3.25Å; P105-T128 WeakPolarHBondContact CG-OG1 3.36Å; T128-S208 PolarHBondContact O-OG 3.46Å
129	R	76.6	Confident	77.8	Confident	36 Å²	36	65.2 Å²	65.2	14%	0.136	35%	0.345	C	S	.	.	B	Isolated β-bridge	trans	-81.5	144.5	176.8	-56.4	-174.9	-161.7	171	-4.7	111.1	Y38 A39 N40 D136 V210	Y38-R129 PolarHBondContact O-NH2 2.87Å; A39-R129 PolarHBondContact O-N 3.21Å; A39-R129 VanDerWaalsContact O-N 3.12Å; N40-R129 WeakPolarHBondContact OD1-CB 3.5Å; N40-R129 WeakPolarHBondContact OD1-CD 3.29Å; R129-D136 WeakPolarHBondContact CD-OD1 3.47Å; R129-D136 IonicContact CZ-OD2 3Å; R129-D136 VanDerWaalsContact CZ-OD2 3.25Å; R129-D136 IonicContact NE-OD2 3.82Å; R129-D136 IonicContact NH1-OD1 3.38Å; R129-D136 PolarHBondContact NH1-OD1 2.69Å; R129-D136 IonicContact NH1-OD2 3.2Å; R129-D136 PolarHBondContact NH1-OD2 2.79Å; R129-D136 IonicContact NH2-OD2 2.92Å; R129-V210 HydrophobicContact CG-CB 4.06Å; R129-V210 HydrophobicContact CG-CG2 3.77Å
130	H	72.4	Confident	78.6	Confident	25 Å²	25	69 Å²	69	12%	0.116	35%	0.352	C	S	.	.	P	Polyproline II helix	trans	-67.6	131.1	177	-164.9	-99.6	0	0	0	111.2	E132 S208	H130-E132 VanDerWaalsContact C-N 3.27Å; H130-E132 VanDerWaalsContact CE1-CD 3.42Å; H130-E132 VanDerWaalsContact CE1-CG 3.46Å; H130-E132 WeakPolarHBondContact CE1-CG 3.16Å; H130-E132 IonicContact CE1-OE1 2.71Å; H130-E132 IonicContact CE1-OE2 2.75Å; H130-E132 PolarHBondContact CE1-OE2 2.83Å; H130-E132 WeakPolarHBondContact ND1-CB 3.45Å; H130-E132 PolarHBondContact ND1-N 2.84Å; H130-E132 IonicContact ND1-OE2 2.81Å; H130-E132 PolarHBondContact O-N 2.79Å; H130-S208 WeakPolarHBondContact CB-O 3.43Å; H130-S208 PolarHBondContact N-O 2.94Å
131	P	63.5	Low	78.9	Confident	117 Å²	117	65.4 Å²	65.4	76%	0.76	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.3	-5.2	-171.3	27.6	-35	0	0	0	115.5	H133	P131-H133 PolarHBondContact O-N 2.88Å
132	E	62.6	Low	78.5	Confident	107 Å²	107	65.5 Å²	65.5	50%	0.5	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.3	-8.6	-175.6	-79.6	179.6	173.3	0	0	114.3	H130 R157	H130-E132 VanDerWaalsContact C-N 3.27Å; H130-E132 VanDerWaalsContact CE1-CD 3.42Å; H130-E132 VanDerWaalsContact CE1-CG 3.46Å; H130-E132 WeakPolarHBondContact CE1-CG 3.16Å; H130-E132 IonicContact CE1-OE1 2.71Å; H130-E132 IonicContact CE1-OE2 2.75Å; H130-E132 PolarHBondContact CE1-OE2 2.83Å; H130-E132 WeakPolarHBondContact ND1-CB 3.45Å; H130-E132 PolarHBondContact ND1-N 2.84Å; H130-E132 IonicContact ND1-OE2 2.81Å; H130-E132 PolarHBondContact O-N 2.79Å; E132-R157 IonicContact OE1-NH2 3.82Å; E132-R157 PolarHBondContact OE1-NH2 3.2Å; E132-R157 IonicContact OE2-NH2 2.69Å; E132-R157 PolarHBondContact OE2-NH2 3Å
133	H	56.8	Low	77.5	Confident	101 Å²	101	70 Å²	70	47%	0.468	36%	0.359	S	S	.	.			trans	-126.5	115	176.6	-61.3	-67.5	0	0	0	110.4	P131 E135	P131-H133 PolarHBondContact O-N 2.88Å; H133-E135 PolarHBondContact O-N 3.46Å
134	L	55.6	Low	76.2	Confident	186 Å²	186	73.8 Å²	73.8	97%	0.974	38%	0.382	S	S	*	.	S	Bend	trans	-66.4	-20.5	-179	-83.3	136.4	0	0	0	113.3
135	E	64.5	Low	74.9	Confident	166 Å²	166	75.8 Å²	75.8	78%	0.776	40%	0.395	S	S	*	.	S	Bend	trans	-133.9	135.1	174.8	-68.6	177.8	-179.4	0	0	109	H133	H133-E135 PolarHBondContact O-N 3.46Å
136	D	68.2	Low	74.5	Confident	27 Å²	27	75 Å²	75	14%	0.144	40%	0.402	C	S	.	.			trans	-63.7	130.3	173.7	-66.9	-19.7	0	0	0	108.4	R129 T138 Q212	R129-D136 WeakPolarHBondContact CD-OD1 3.47Å; R129-D136 IonicContact CZ-OD2 3Å; R129-D136 VanDerWaalsContact CZ-OD2 3.25Å; R129-D136 IonicContact NE-OD2 3.82Å; R129-D136 IonicContact NH1-OD1 3.38Å; R129-D136 PolarHBondContact NH1-OD1 2.69Å; R129-D136 IonicContact NH1-OD2 3.2Å; R129-D136 PolarHBondContact NH1-OD2 2.79Å; R129-D136 IonicContact NH2-OD2 2.92Å; D136-T138 PolarHBondContact O-N 2.97Å; D136-T138 VanDerWaalsContact O-N 3.13Å; D136-T138 PolarHBondContact O-OG1 3.03Å; D136-Q212 HydrophobicContact CB-CG 4.41Å; D136-Q212 PolarHBondContact OD2-NE2 2.93Å
137	P	82.2	Confident	74.5	Confident	56 Å²	56	77.3 Å²	77.3	36%	0.364	41%	0.414	S	S	.	.			trans	-59.6	126	174.2	-16.6	27.9	0	0	0	109.3	F211 Q212	P137-F211 HydrophobicContact CB-CD1 3.85Å; P137-F211 HydrophobicContact CB-CE1 4.41Å; P137-F211 HydrophobicContact CG-CD1 3.66Å; P137-F211 HydrophobicContact CG-CE1 3.86Å; P137-F211 WeakPolarHBondContact O-CA 2.65Å; P137-Q212 PolarHBondContact O-N 2.72Å
138	T	86.1	Confident	75	Confident	66 Å²	66	79.6 Å²	79.6	41%	0.405	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	130.2	-167	-66.9	0	0	0	0	109.7	D136 Q212 R214	D136-T138 PolarHBondContact O-N 2.97Å; D136-T138 VanDerWaalsContact O-N 3.13Å; D136-T138 PolarHBondContact O-OG1 3.03Å; T138-Q212 CarbonylContact C-O 3.54Å; T138-Q212 VanDerWaalsContact CA-O 3.28Å; T138-Q212 WeakPolarHBondContact CA-O 2.95Å; T138-Q212 HydrophobicContact CG2-CB 4.46Å; T138-R214 HydrophobicContact CG2-CB 4.43Å; T138-R214 HydrophobicContact CG2-CG 4.02Å
139	I	91.4	Very high	75.7	Confident	33 Å²	33	78.7 Å²	78.7	17%	0.169	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	127.4	173.5	-62.1	177.6	0	0	0	108	L141 I147 I149 F151 Q212 V213 R214	I139-L141 HydrophobicContact CG2-CD2 4.23Å; I139-I147 HydrophobicContact CG2-CG2 4.24Å; I139-I149 HydrophobicContact CD1-CB 4.19Å; I139-I149 HydrophobicContact CD1-CG2 3.8Å; I139-F151 HydrophobicContact CD1-CD1 4.32Å; I139-F151 HydrophobicContact CD1-CE1 3.64Å; I139-F151 HydrophobicContact CD1-CZ 3.79Å; I139-F151 HydrophobicContact CG1-CE1 3.84Å; I139-F151 HydrophobicContact CG1-CZ 4.05Å; I139-Q212 PolarHBondContact N-O 3.44Å; I139-V213 HydrophobicContact CB-CG2 4.5Å; I139-V213 CarbonylContact O-C 3.49Å; I139-V213 WeakPolarHBondContact O-CA 3.07Å; I139-R214 PolarHBondContact O-N 3.1Å
140	E	91.4	Very high	76.6	Confident	121 Å²	121	81.6 Å²	81.6	57%	0.565	44%	0.441	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.5	124.5	175	-61.3	-166.4	152.6	0	0	110.4	I147 R214	E140-I147 WeakPolarHBondContact O-CD1 3.47Å; E140-R214 WeakPolarHBondContact CA-O 3.42Å; E140-R214 HydrophobicContact CG-CB 4.36Å
141	L	90.2	Very high	77.6	Confident	9 Å²	9	80.8 Å²	80.8	5%	0.047	44%	0.437	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	132.5	175.3	-61.7	-175.3	0	0	0	110.9	I139 I147 I149 S191 V213 R214	I139-L141 HydrophobicContact CG2-CD2 4.23Å; L141-I147 HydrophobicContact CD2-CB 3.84Å; L141-I147 HydrophobicContact CD2-CD1 4.37Å; L141-I147 HydrophobicContact CD2-CG2 4.32Å; L141-I149 HydrophobicContact CD1-CD1 4.39Å; L141-I149 HydrophobicContact CD2-CG1 4.48Å; L141-S191 WeakPolarHBondContact CD1-O 3.43Å; L141-V213 HydrophobicContact CD1-CG1 3.55Å; L141-V213 HydrophobicContact CD2-CG1 4.42Å; L141-V213 HydrophobicContact CG-CG1 3.66Å; L141-R214 PolarHBondContact N-O 3.35Å
142	N	81	Confident	79	Confident	105 Å²	105	80.5 Å²	80.5	56%	0.561	43%	0.425	S	S	*	.			trans	-105.6	146.3	170.6	-65.1	-13.3	0	0	0	109.7	T144 S145	N142-T144 PolarHBondContact O-N 3.22Å; N142-S145 PolarHBondContact O-N 3.4Å; N142-S145 PolarHBondContact O-OG 2.97Å
143	E	65.2	Low	80.2	Confident	120 Å²	120	75.9 Å²	75.9	56%	0.561	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.8	-24.9	-175.8	-79	-177.5	156.4	0	0	114.8	K216	E143-K216 WeakPolarHBondContact OE1-CE 3.5Å; E143-K216 IonicContact OE1-NZ 3.34Å; E143-K216 PolarHBondContact OE1-NZ 2.94Å; E143-K216 WeakPolarHBondContact OE2-CE 3.38Å; E143-K216 IonicContact OE2-NZ 3.7Å; E143-K216 PolarHBondContact OE2-NZ 2.9Å
144	T	64.4	Low	81.6	Confident	138 Å²	138	72.7 Å²	72.7	85%	0.847	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.4	-2.6	-170.2	46.8	0	0	0	0	114.3	N142	N142-T144 PolarHBondContact O-N 3.22Å
145	S	61.3	Low	82.7	Confident	42 Å²	42	64.5 Å²	64.5	29%	0.294	35%	0.35	S	S	.	.			trans	-130.5	121.9	-170.7	55	0	0	0	0	112.6	N142 I147	N142-S145 PolarHBondContact O-N 3.4Å; N142-S145 PolarHBondContact O-OG 2.97Å; S145-I147 PolarHBondContact O-N 3.37Å; S145-I147 VanDerWaalsContact OG-CD1 3.23Å; S145-I147 WeakPolarHBondContact OG-CD1 3.26Å; S145-I147 WeakPolarHBondContact OG-CG1 3.29Å
146	S	80.2	Confident	83	Confident	79 Å²	79	59.1 Å²	59.1	55%	0.552	33%	0.327	S	S	*	.			trans	-73.7	72.2	167.1	61	0	0	0	0	110
147	I	88.8	Confident	82.9	Confident	50 Å²	50	64.9 Å²	64.9	26%	0.256	35%	0.346	S	S	.	.	P	Polyproline II helix	trans	-73.2	128.2	179.5	-64.9	165.9	0	0	0	108	I139 E140 L141 S145 G190	I139-I147 HydrophobicContact CG2-CG2 4.24Å; E140-I147 WeakPolarHBondContact O-CD1 3.47Å; L141-I147 HydrophobicContact CD2-CB 3.84Å; L141-I147 HydrophobicContact CD2-CD1 4.37Å; L141-I147 HydrophobicContact CD2-CG2 4.32Å; S145-I147 PolarHBondContact O-N 3.37Å; S145-I147 VanDerWaalsContact OG-CD1 3.23Å; S145-I147 WeakPolarHBondContact OG-CD1 3.26Å; S145-I147 WeakPolarHBondContact OG-CG1 3.29Å; I147-G190 WeakPolarHBondContact O-CA 3.39Å; I147-G190 PolarHBondContact O-N 3Å
148	P	93.6	Very high	81.8	Confident	69 Å²	69	74.1 Å²	74.1	45%	0.448	37%	0.374	S	S	.	.	P	Polyproline II helix	trans	-66.5	138.9	173.1	27.7	-33.3	0	0	0	110.3	F186 I187	P148-F186 HydrophobicContact CB-CE2 3.9Å; P148-F186 HydrophobicContact CB-CZ 4.3Å; P148-I187 CarbonylContact C-O 3.57Å; P148-I187 VanDerWaalsContact CA-O 3.28Å; P148-I187 WeakPolarHBondContact CA-O 3.49Å
149	I	94.7	Very high	80.4	Confident	0 Å²	0	74.8 Å²	74.8	0%	0	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	119.4	174.1	-58	163.5	0	0	0	107	I139 L141 F151 L185 F186 I187 D194 V213	I139-I149 HydrophobicContact CD1-CB 4.19Å; I139-I149 HydrophobicContact CD1-CG2 3.8Å; L141-I149 HydrophobicContact CD1-CD1 4.39Å; L141-I149 HydrophobicContact CD2-CG1 4.48Å; I149-F151 HydrophobicContact CG2-CD2 3.96Å; I149-F151 HydrophobicContact CG2-CE2 3.51Å; I149-F151 HydrophobicContact CG2-CZ 3.99Å; I149-L185 HydrophobicContact CG2-CD2 4.41Å; I149-F186 CarbonylContact O-C 3.6Å; I149-F186 VanDerWaalsContact O-CA 3.31Å; I149-F186 WeakPolarHBondContact O-CA 3.24Å; I149-I187 HydrophobicContact CB-CB 4.09Å; I149-I187 HydrophobicContact CB-CD1 4.5Å; I149-I187 HydrophobicContact CD1-CB 4.44Å; I149-I187 HydrophobicContact CD1-CD1 4.08Å; I149-I187 PolarHBondContact N-O 2.89Å; I149-I187 PolarHBondContact O-N 3.21Å; I149-D194 HydrophobicContact CD1-CB 3.65Å; I149-V213 HydrophobicContact CD1-CG1 3.95Å; I149-V213 HydrophobicContact CD1-CG2 4.08Å; I149-V213 HydrophobicContact CG1-CG1 4.49Å; I149-V213 HydrophobicContact CG1-CG2 4.39Å; I149-V213 HydrophobicContact CG2-CG2 3.81Å
150	E	95	Very high	79	Confident	97 Å²	97	77.1 Å²	77.1	45%	0.453	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	124.4	176.9	-169	171.6	-177	0	0	110	H152 T184 L185 F186	E150-H152 IonicContact OE1-CE1 3.25Å; E150-H152 PolarHBondContact OE1-CE1 2.86Å; E150-H152 IonicContact OE1-NE2 3.63Å; E150-T184 HydrophobicContact CG-CG2 3.96Å; E150-L185 WeakPolarHBondContact CA-O 3.49Å; E150-F186 HydrophobicContact CB-CD2 3.95Å; E150-F186 HydrophobicContact CB-CE2 4.5Å; E150-F186 HydrophobicContact CG-CD2 4.1Å
151	F	93.7	Very high	78.6	Confident	7 Å²	7	75.4 Å²	75.4	3%	0.031	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	135.1	175.3	-63.8	-53	0	0	0	110.9	I139 I149 W164 T184 L185 Y198 F211 V213	I139-F151 HydrophobicContact CD1-CD1 4.32Å; I139-F151 HydrophobicContact CD1-CE1 3.64Å; I139-F151 HydrophobicContact CD1-CZ 3.79Å; I139-F151 HydrophobicContact CG1-CE1 3.84Å; I139-F151 HydrophobicContact CG1-CZ 4.05Å; I149-F151 HydrophobicContact CG2-CD2 3.96Å; I149-F151 HydrophobicContact CG2-CE2 3.51Å; I149-F151 HydrophobicContact CG2-CZ 3.99Å; F151-W164 HydrophobicContact CB-CH2 3.5Å; F151-W164 VanDerWaalsContact CB-CH2 3.5Å; F151-W164 HydrophobicContact CB-CZ2 4.27Å; F151-W164 HydrophobicContact CB-CZ3 4.11Å; F151-W164 HydrophobicContact CG-CH2 4.5Å; F151-T184 CarbonylContact O-C 3.52Å; F151-T184 WeakPolarHBondContact O-CA 3.41Å; F151-L185 HydrophobicContact CD2-CD2 4.26Å; F151-L185 PolarHBondContact N-O 2.78Å; F151-L185 PolarHBondContact O-N 2.82Å; F151-Y198 HydrophobicContact CD2-CG 4.22Å; F151-Y198 AromaticContact CE2-CD2 3.78Å; F151-Y198 HydrophobicContact CE2-CD2 3.78Å; F151-Y198 HydrophobicContact CE2-CE2 4.38Å; F151-Y198 AromaticContact CE2-CG 3.92Å; F151-Y198 HydrophobicContact CE2-CG 3.92Å; F151-F211 HydrophobicContact CB-CD1 3.91Å; F151-F211 HydrophobicContact CB-CD2 4.48Å; F151-F211 HydrophobicContact CB-CE1 4.04Å; F151-F211 HydrophobicContact CB-CG 4.15Å; F151-F211 HydrophobicContact CB-CZ 4.41Å; F151-F211 HydrophobicContact CD1-CB 3.8Å; F151-F211 AromaticContact CD1-CD1 3.44Å; F151-F211 HydrophobicContact CD1-CD1 3.44Å; F151-F211 VanDerWaalsContact CD1-CD1 3.44Å; F151-F211 HydrophobicContact CD1-CE1 4.24Å; F151-F211 AromaticContact CD1-CG 3.82Å; F151-F211 HydrophobicContact CD1-CG 3.82Å; F151-F211 HydrophobicContact CD2-CB 3.9Å; F151-F211 HydrophobicContact CD2-CG 4.15Å; F151-F211 HydrophobicContact CE1-CB 3.67Å; F151-F211 HydrophobicContact CE1-CD1 4.03Å; F151-F211 HydrophobicContact CE1-CG 4.21Å; F151-F211 HydrophobicContact CE2-CB 3.78Å; F151-F211 HydrophobicContact CG-CB 3.92Å; F151-F211 AromaticContact CG-CD1 3.73Å; F151-F211 HydrophobicContact CG-CD1 3.73Å; F151-F211 HydrophobicContact CG-CD2 4.47Å; F151-F211 HydrophobicContact CG-CE1 4.37Å; F151-F211 AromaticContact CG-CG 3.8Å; F151-F211 HydrophobicContact CG-CG 3.8Å; F151-F211 HydrophobicContact CZ-CB 3.66Å; F151-V213 HydrophobicContact CE2-CG2 3.68Å; F151-V213 HydrophobicContact CZ-CG2 3.64Å
152	H	91.1	Very high	78.5	Confident	112 Å²	112	76.2 Å²	76.2	52%	0.519	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	123.4	174.9	-56.7	-67.1	0	0	0	109.9	E150 P154 T184 F211	E150-H152 IonicContact OE1-CE1 3.25Å; E150-H152 PolarHBondContact OE1-CE1 2.86Å; E150-H152 IonicContact OE1-NE2 3.63Å; H152-P154 WeakPolarHBondContact O-CD 3.4Å; H152-T184 WeakPolarHBondContact ND1-CG2 3.43Å; H152-T184 PolarHBondContact ND1-OG1 2.87Å; H152-F211 WeakPolarHBondContact O-CZ 3.3Å
153	C	89	Confident	79	Confident	9 Å²	9	75.9 Å²	75.9	6%	0.061	40%	0.4	C	S	.	.			trans	-75.1	116.9	179.5	-172.2	0	0	0	0	111.5	L155 D156 V162 W164 G183 C200	C153-L155 PolarHBondContact O-N 3.47Å; C153-L155 VanDerWaalsContact O-N 3.13Å; C153-D156 PolarHBondContact O-N 2.76Å; C153-V162 HydrophobicContact CB-CG1 4.4Å; C153-V162 HydrophobicContact CB-CG2 4.3Å; C153-W164 HydrophobicContact CB-CZ2 3.89Å; C153-G183 WeakPolarHBondContact CB-O 3.06Å; C153-G183 PolarHBondContact N-O 2.85Å; C153-C200 VanDerWaalsContact CA-SG 3.54Å; C153-C200 HydrophobicContact CB-CB 3.62Å; C153-C200 WeakPolarHBondContact CB-SG 3.5Å; C153-C200 WeakPolarHBondContact SG-CB 3.42Å; C153-C200 CovalentContact SG-SG 2.03Å; C153-C200 PolarHBondContact SG-SG 2.6Å
154	P	85.3	Confident	80.3	Confident	35 Å²	35	70.6 Å²	70.6	23%	0.227	38%	0.375	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.8	-11.2	-178.7	30.1	-36.5	0	0	0	113.3	H152 D156 A209	H152-P154 WeakPolarHBondContact O-CD 3.4Å; P154-D156 VanDerWaalsContact C-N 3.34Å; P154-A209 HydrophobicContact CG-CB 3.66Å
155	L	80.3	Confident	81.6	Confident	14 Å²	14	64.8 Å²	64.8	7%	0.073	34%	0.338	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.1	-8.9	-178.4	-56.4	177.5	0	0	0	113.3	C153 R157 A202 R207	C153-L155 PolarHBondContact O-N 3.47Å; C153-L155 VanDerWaalsContact O-N 3.13Å; L155-R157 VanDerWaalsContact C-N 3.3Å; L155-R157 PolarHBondContact O-N 2.86Å; L155-A202 HydrophobicContact CB-CB 4.24Å; L155-A202 HydrophobicContact CD1-CB 4.39Å; L155-R207 HydrophobicContact CD1-CB 4.2Å; L155-R207 VanDerWaalsContact CD1-O 3.31Å; L155-R207 WeakPolarHBondContact CD1-O 3.36Å; L155-R207 HydrophobicContact CD2-CB 4.24Å
156	D	69.4	Low	83.1	Confident	53 Å²	53	64.4 Å²	64.4	28%	0.283	33%	0.332	S	S	.	.			trans	-72.8	86.8	174.2	-173.6	16.4	0	0	0	110.2	C153 P154 V162 N182	C153-D156 PolarHBondContact O-N 2.76Å; P154-D156 VanDerWaalsContact C-N 3.34Å; D156-V162 HydrophobicContact CB-CG1 4.36Å; D156-N182 WeakPolarHBondContact OD2-CA 3.39Å
157	R	66.2	Low	83.4	Confident	147 Å²	147	61.6 Å²	61.6	56%	0.555	31%	0.311	S	S	*	.			trans	-115.8	107.2	172.1	-64.4	-170.3	-173.2	-179.1	6.6	108.9	E132 L155	E132-R157 IonicContact OE1-NH2 3.82Å; E132-R157 PolarHBondContact OE1-NH2 3.2Å; E132-R157 IonicContact OE2-NH2 2.69Å; E132-R157 PolarHBondContact OE2-NH2 3Å; L155-R157 VanDerWaalsContact C-N 3.3Å; L155-R157 PolarHBondContact O-N 2.86Å
158	R	60.5	Low	83.2	Confident	251 Å²	251	60.1 Å²	60.1	95%	0.947	31%	0.308	S	S	*	.	S	Bend	trans	50.4	80.3	170.3	-67.2	-175.9	-179.9	175.5	0.3	114.4
159	G	56.5	Low	83	Confident	80 Å²	80	64.4 Å²	64.4	83%	0.825	32%	0.319	S	S	*	.	S	Bend	trans	79.9	21.1	162.4	0	0	0	0	0	115
160	K	60.7	Low	82.8	Confident	81 Å²	81	68.7 Å²	68.7	35%	0.352	34%	0.339	S	S	.	.			trans	-103.9	110.2	175.2	-73.7	176.1	167.4	-150.3	0	108.7	V162 S204	K160-V162 PolarHBondContact O-N 2.9Å; K160-S204 WeakPolarHBondContact CD-OG 3.43Å; K160-S204 WeakPolarHBondContact CE-OG 3.36Å; K160-S204 PolarHBondContact NZ-OG 3.34Å
161	S	82.9	Confident	82.8	Confident	85 Å²	85	65.5 Å²	65.5	59%	0.594	33%	0.325	S	S	*	.			trans	-59.7	139.2	174.9	-49.5	0	0	0	0	110.3	T203	S161-T203 WeakPolarHBondContact O-CB 2.89Å; S161-T203 WeakPolarHBondContact O-CG2 3.43Å; S161-T203 PolarHBondContact O-N 3.16Å; S161-T203 PolarHBondContact O-OG1 2.98Å
162	V	88.4	Confident	82.9	Confident	26 Å²	26	72.4 Å²	72.4	16%	0.158	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	150.4	174.4	-61.9	0	0	0	0	109.8	C153 D156 K160 Q201	C153-V162 HydrophobicContact CB-CG1 4.4Å; C153-V162 HydrophobicContact CB-CG2 4.3Å; D156-V162 HydrophobicContact CB-CG1 4.36Å; K160-V162 PolarHBondContact O-N 2.9Å; V162-Q201 WeakPolarHBondContact CA-O 3.29Å
163	R	91.6	Very high	83	Confident	99 Å²	99	70.8 Å²	70.8	37%	0.374	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	135.5	171.3	-66.7	-177	-63.5	172.4	-1	109.1	F165 C200 Q201 T203	R163-F165 HydrophobicContact CB-CE2 3.74Å; R163-F165 HydrophobicContact CB-CZ 4.25Å; R163-C200 CarbonylContact O-C 3.59Å; R163-C200 WeakPolarHBondContact O-CA 3.19Å; R163-Q201 PolarHBondContact N-O 3.4Å; R163-Q201 PolarHBondContact O-N 3.17Å; R163-T203 HydrophobicContact CG-CG2 4.01Å
164	W	93.4	Very high	83.4	Confident	8 Å²	8	73.1 Å²	73.1	3%	0.03	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	143.1	176.6	-77.8	98.6	0	0	0	110.9	F151 C153 L171 L179 G183 L185 M199 C200 F211	F151-W164 HydrophobicContact CB-CH2 3.5Å; F151-W164 VanDerWaalsContact CB-CH2 3.5Å; F151-W164 HydrophobicContact CB-CZ2 4.27Å; F151-W164 HydrophobicContact CB-CZ3 4.11Å; F151-W164 HydrophobicContact CG-CH2 4.5Å; C153-W164 HydrophobicContact CB-CZ2 3.89Å; W164-L171 HydrophobicContact CB-CB 4.25Å; W164-L171 HydrophobicContact CB-CD1 4.19Å; W164-L171 PolarHBondContact O-N 3.37Å; W164-L179 HydrophobicContact CB-CD2 3.99Å; W164-L179 HydrophobicContact CG-CD2 3.97Å; W164-G183 WeakPolarHBondContact CZ2-O 3.3Å; W164-G183 PolarHBondContact NE1-O 3.02Å; W164-G183 VanDerWaalsContact NE1-O 3.13Å; W164-L185 HydrophobicContact CB-CD1 4.16Å; W164-L185 HydrophobicContact CD2-CB 3.79Å; W164-L185 HydrophobicContact CD2-CD1 3.75Å; W164-L185 HydrophobicContact CD2-CG 4.45Å; W164-L185 HydrophobicContact CE3-CB 4.13Å; W164-L185 HydrophobicContact CE3-CD1 3.64Å; W164-L185 HydrophobicContact CG-CB 4.27Å; W164-L185 HydrophobicContact CG-CD1 4.01Å; W164-L185 HydrophobicContact CH2-CB 4.16Å; W164-L185 HydrophobicContact CZ2-CB 3.81Å; W164-L185 HydrophobicContact CZ3-CB 4.3Å; W164-L185 HydrophobicContact CZ3-CD1 4.24Å; W164-M199 CarbonylContact C-O 3.59Å; W164-M199 WeakPolarHBondContact CA-O 3.44Å; W164-C200 HydrophobicContact CD2-CB 3.85Å; W164-C200 HydrophobicContact CE3-CB 3.87Å; W164-C200 HydrophobicContact CH2-CB 3.85Å; W164-C200 HydrophobicContact CZ2-CB 3.83Å; W164-C200 HydrophobicContact CZ3-CB 3.87Å; W164-F211 AromaticContact CH2-CD2 3.79Å; W164-F211 HydrophobicContact CH2-CD2 3.79Å; W164-F211 AromaticContact CH2-CE2 3.33Å; W164-F211 HydrophobicContact CH2-CE2 3.33Å; W164-F211 AromaticContact CH2-CZ 3.79Å; W164-F211 HydrophobicContact CH2-CZ 3.79Å; W164-F211 HydrophobicContact CZ2-CE2 4.48Å; W164-F211 AromaticContact CZ3-CD2 3.56Å; W164-F211 HydrophobicContact CZ3-CD2 3.56Å; W164-F211 AromaticContact CZ3-CE2 3.51Å; W164-F211 HydrophobicContact CZ3-CE2 3.51Å; W164-F211 HydrophobicContact CZ3-CG 4.5Å; W164-F211 HydrophobicContact CZ3-CZ 4.4Å
165	F	92	Very high	83.8	Confident	17 Å²	17	79.7 Å²	79.7	8%	0.075	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	143.6	176.1	-60.3	-101.3	0	0	0	108.5	R163 K169 Q170 Y198 M199 Q201	R163-F165 HydrophobicContact CB-CE2 3.74Å; R163-F165 HydrophobicContact CB-CZ 4.25Å; F165-K169 CarbonylContact C-O 3.58Å; F165-K169 WeakPolarHBondContact CA-O 3.5Å; F165-Q170 HydrophobicContact CD1-CB 3.91Å; F165-Q170 HydrophobicContact CD1-CG 4.44Å; F165-Q170 HydrophobicContact CE1-CB 3.7Å; F165-Q170 HydrophobicContact CE1-CG 4.06Å; F165-Q170 HydrophobicContact CZ-CB 4.39Å; F165-Q170 HydrophobicContact CZ-CG 4.26Å; F165-Y198 CarbonylContact O-C 3.56Å; F165-Y198 VanDerWaalsContact O-CA 3.31Å; F165-Y198 WeakPolarHBondContact O-CA 3.49Å; F165-M199 HydrophobicContact CB-CB 4.36Å; F165-M199 HydrophobicContact CB-CE 4.04Å; F165-M199 HydrophobicContact CD1-CE 4.44Å; F165-M199 HydrophobicContact CD2-CE 3.43Å; F165-M199 VanDerWaalsContact CD2-CE 3.43Å; F165-M199 HydrophobicContact CE2-CE 3.97Å; F165-M199 HydrophobicContact CG-CE 3.72Å; F165-M199 PolarHBondContact N-O 3.19Å; F165-M199 PolarHBondContact O-N 2.85Å; F165-Q201 HydrophobicContact CE2-CB 4.1Å
166	H	91.5	Very high	84.5	Confident	34 Å²	34	82.7 Å²	82.7	16%	0.157	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	120.6	169.4	175.1	-131.7	0	0	0	107.5	G168 K169 L171 D194 V197 Y198	H166-G168 PolarHBondContact O-N 2.87Å; H166-K169 PolarHBondContact N-O 3.39Å; H166-K169 PolarHBondContact O-N 2.81Å; H166-L171 HydrophobicContact CB-CD1 3.88Å; H166-L171 HydrophobicContact CB-CD2 3.74Å; H166-L171 HydrophobicContact CB-CG 3.87Å; H166-D194 PolarHBondContact NE2-O 2.84Å; H166-V197 WeakPolarHBondContact CA-O 3.42Å; H166-Y198 HydrophobicContact CB-CD1 4.07Å; H166-Y198 HydrophobicContact CB-CE1 3.9Å; H166-Y198 AromaticContact CD2-CD2 3.9Å; H166-Y198 AromaticContact CD2-CE1 3.71Å; H166-Y198 AromaticContact CD2-CE2 3.46Å; H166-Y198 VanDerWaalsContact CD2-CE2 3.46Å; H166-Y198 WeakPolarHBondContact CD2-CE2 3.28Å; H166-Y198 AromaticContact CD2-CZ 3.36Å; H166-Y198 AromaticContact CG-CE1 3.89Å; H166-Y198 AromaticContact CG-CZ 3.91Å; H166-Y198 AromaticContact NE2-CE2 3.8Å; H166-Y198 AromaticContact NE2-CZ 3.74Å
167	D	87.2	Confident	85.8	Confident	20 Å²	20	80.7 Å²	80.7	11%	0.107	41%	0.412	C	S	.	.	T	Hydrogen-bonded Turn	trans	48.1	47.9	-176.8	-73	-11.4	0	0	0	111.5	R33 N34 K169 G196 V197	R33-D167 HydrophobicContact CB-CB 3.77Å; R33-D167 VanDerWaalsContact CD-CG 3.5Å; R33-D167 WeakPolarHBondContact CD-OD2 3.48Å; R33-D167 HydrophobicContact CG-CB 4.14Å; R33-D167 VanDerWaalsContact CG-OD1 3.31Å; R33-D167 WeakPolarHBondContact CG-OD1 3.3Å; R33-D167 IonicContact CZ-OD2 3.89Å; R33-D167 IonicContact NE-OD1 3.99Å; R33-D167 IonicContact NE-OD2 2.63Å; R33-D167 PolarHBondContact NE-OD2 2.02Å; N34-D167 VanDerWaalsContact CB-O 3.27Å; N34-D167 WeakPolarHBondContact CB-O 3.06Å; N34-D167 PolarHBondContact ND2-O 3.12Å; D167-K169 PolarHBondContact O-N 2.91Å; D167-K169 VanDerWaalsContact O-N 3.09Å; D167-G196 WeakPolarHBondContact OD1-CA 3.28Å; D167-V197 PolarHBondContact N-O 3.31Å; D167-V197 PolarHBondContact OD1-N 2.78Å
168	G	84.3	Confident	87.2	Confident	19 Å²	19	76 Å²	76	20%	0.196	40%	0.398	C	S	.	.	T	Hydrogen-bonded Turn	trans	74.9	-12.1	179.7	0	0	0	0	0	116.7	D36 Y38 H166	D36-G168 WeakPolarHBondContact OD2-CA 3.35Å; Y38-G168 VanDerWaalsContact OH-CA 3.25Å; Y38-G168 WeakPolarHBondContact OH-CA 3.49Å; Y38-G168 PolarHBondContact OH-N 2.95Å; H166-G168 PolarHBondContact O-N 2.87Å
169	K	88.3	Confident	88.9	Confident	158 Å²	158	66.5 Å²	66.5	69%	0.687	37%	0.365	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.1	128.7	175.2	-170.2	-179.8	177.2	-173.9	0	110.1	F165 H166 D167 L171	F165-K169 CarbonylContact C-O 3.58Å; F165-K169 WeakPolarHBondContact CA-O 3.5Å; H166-K169 PolarHBondContact N-O 3.39Å; H166-K169 PolarHBondContact O-N 2.81Å; D167-K169 PolarHBondContact O-N 2.91Å; D167-K169 VanDerWaalsContact O-N 3.09Å; K169-L171 PolarHBondContact O-N 3.41Å
170	Q	92.3	Very high	90.5	Very high	91 Å²	91	67.6 Å²	67.6	43%	0.425	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.6	129.8	174.4	-168	178.8	-58.3	0	0	109.6	F165	F165-Q170 HydrophobicContact CD1-CB 3.91Å; F165-Q170 HydrophobicContact CD1-CG 4.44Å; F165-Q170 HydrophobicContact CE1-CB 3.7Å; F165-Q170 HydrophobicContact CE1-CG 4.06Å; F165-Q170 HydrophobicContact CZ-CB 4.39Å; F165-Q170 HydrophobicContact CZ-CG 4.26Å
171	L	95	Very high	91.8	Very high	30 Å²	30	73.1 Å²	73.1	16%	0.157	38%	0.375	C	S	.	.	P	Polyproline II helix	trans	-83.3	146.9	175.9	-70.6	175.6	0	0	0	110.6	W164 H166 K169 V177 L179 L185 Y198	W164-L171 HydrophobicContact CB-CB 4.25Å; W164-L171 HydrophobicContact CB-CD1 4.19Å; W164-L171 PolarHBondContact O-N 3.37Å; H166-L171 HydrophobicContact CB-CD1 3.88Å; H166-L171 HydrophobicContact CB-CD2 3.74Å; H166-L171 HydrophobicContact CB-CG 3.87Å; K169-L171 PolarHBondContact O-N 3.41Å; L171-V177 HydrophobicContact CD1-CG1 4.3Å; L171-L179 HydrophobicContact CB-CD1 4.19Å; L171-L185 HydrophobicContact CD1-CD1 3.46Å; L171-L185 VanDerWaalsContact CD1-CD1 3.46Å; L171-Y198 HydrophobicContact CD1-CD1 4.05Å; L171-Y198 HydrophobicContact CD1-CE1 4Å
172	E	94.8	Very high	92	Very high	152 Å²	152	73.7 Å²	73.7	71%	0.71	37%	0.371	S	S	*	.			trans	-122.6	151.2	170.4	-65.6	-178.7	175	0	0	108.3	S174	E172-S174 PolarHBondContact O-N 3.01Å
173	S	94.2	Very high	92	Very high	78 Å²	78	72.5 Å²	72.5	55%	0.545	36%	0.364	S	S	.	.			trans	-65.3	135.3	176.3	-156.4	0	0	0	0	109.8	V177	S173-V177 CarbonylContact C-O 3.51Å; S173-V177 WeakPolarHBondContact CA-O 3.24Å; S173-V177 PolarHBondContact OG-O 2.83Å
174	S	95.9	Very high	92.1	Very high	58 Å²	58	68 Å²	68	41%	0.406	35%	0.347	S	S	.	.			trans	-150.7	178	-178.3	62.4	0	0	0	0	110.3	E172 H176 V177	E172-S174 PolarHBondContact O-N 3.01Å; S174-H176 PolarHBondContact O-N 3.17Å; S174-H176 VanDerWaalsContact O-N 3.17Å; S174-V177 PolarHBondContact N-O 2.97Å; S174-V177 CarbonylContact O-C 3.54Å; S174-V177 PolarHBondContact O-N 3.47Å; S174-V177 PolarHBondContact OG-N 3.22Å
175	D	94.2	Very high	92.2	Very high	173 Å²	173	67.6 Å²	67.6	93%	0.925	35%	0.346	S	S	*	.	S	Bend	trans	-60.2	-24.8	175.7	-64.2	-22.3	0	0	0	113.2
176	H	95.2	Very high	92.4	Very high	76 Å²	76	69.5 Å²	69.5	35%	0.352	35%	0.354	S	S	.	.	S	Bend	trans	-94.2	-34.5	179.3	-174.9	63.2	0	0	0	113	S174 I187 D194	S174-H176 PolarHBondContact O-N 3.17Å; S174-H176 VanDerWaalsContact O-N 3.17Å; H176-I187 VanDerWaalsContact CE1-CG2 3.49Å; H176-I187 WeakPolarHBondContact CE1-CG2 3.38Å; H176-D194 IonicContact CD2-OD1 3.46Å; H176-D194 IonicContact CE1-OD1 3.6Å; H176-D194 IonicContact CE1-OD2 3.97Å; H176-D194 IonicContact NE2-OD1 3.47Å; H176-D194 PolarHBondContact NE2-OD1 3.06Å; H176-D194 IonicContact NE2-OD2 3.17Å; H176-D194 PolarHBondContact NE2-OD2 2.82Å
177	V	96.5	Very high	92.6	Very high	12 Å²	12	67.9 Å²	67.9	7%	0.073	35%	0.347	C	S	.	.			trans	-121.4	116.6	-174.4	-177.3	0	0	0	0	110.1	L171 S173 S174 L179 I187	L171-V177 HydrophobicContact CD1-CG1 4.3Å; S173-V177 CarbonylContact C-O 3.51Å; S173-V177 WeakPolarHBondContact CA-O 3.24Å; S173-V177 PolarHBondContact OG-O 2.83Å; S174-V177 PolarHBondContact N-O 2.97Å; S174-V177 CarbonylContact O-C 3.54Å; S174-V177 PolarHBondContact O-N 3.47Å; S174-V177 PolarHBondContact OG-N 3.22Å; V177-L179 HydrophobicContact CG1-CD2 3.96Å; V177-L179 HydrophobicContact CG1-CG 4.31Å; V177-I187 HydrophobicContact CG2-CD1 4.27Å; V177-I187 HydrophobicContact CG2-CG1 4.19Å
178	N	96.4	Very high	93	Very high	49 Å²	49	69.6 Å²	69.6	26%	0.262	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	127.5	175.3	-58.9	-75	0	0	0	110	F180 F186	N178-F180 HydrophobicContact CB-CE2 4.01Å; N178-F180 HydrophobicContact CB-CZ 4.08Å; N178-F186 HydrophobicContact CB-CB 4.33Å; N178-F186 WeakPolarHBondContact CB-O 3.33Å; N178-F186 PolarHBondContact N-O 2.88Å; N178-F186 PolarHBondContact ND2-O 2.75Å; N178-F186 PolarHBondContact O-N 2.86Å
179	L	94.8	Very high	93.4	Very high	50 Å²	50	75.7 Å²	75.7	26%	0.262	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	120	175.9	-57.3	-179.5	0	0	0	109	W164 L171 V177 L185	W164-L179 HydrophobicContact CB-CD2 3.99Å; W164-L179 HydrophobicContact CG-CD2 3.97Å; L171-L179 HydrophobicContact CB-CD1 4.19Å; V177-L179 HydrophobicContact CG1-CD2 3.96Å; V177-L179 HydrophobicContact CG1-CG 4.31Å; L179-L185 HydrophobicContact CD2-CB 4.07Å; L179-L185 HydrophobicContact CD2-CD1 3.99Å; L179-L185 HydrophobicContact CD2-CG 3.93Å
180	F	91.7	Very high	93.6	Very high	104 Å²	104	68.4 Å²	68.4	46%	0.456	35%	0.35	S	S	.	.			trans	-100.6	150.7	-177.3	-62.5	-79.1	0	0	0	111.6	N178 N182 G183 T184 F186	N178-F180 HydrophobicContact CB-CE2 4.01Å; N178-F180 HydrophobicContact CB-CZ 4.08Å; F180-N182 WeakPolarHBondContact CB-OD1 3.5Å; F180-N182 PolarHBondContact O-N 2.84Å; F180-G183 PolarHBondContact O-N 3.39Å; F180-T184 HydrophobicContact CD2-CG2 4.1Å; F180-T184 PolarHBondContact N-O 3.48Å; F180-F186 HydrophobicContact CD2-CB 4.49Å; F180-F186 HydrophobicContact CE2-CB 3.73Å
181	E	87	Confident	93.6	Very high	197 Å²	197	66.3 Å²	66.3	92%	0.921	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.1	-27.7	-179.6	-66.7	-172.4	163.9	0	0	113.4	G183	E181-G183 PolarHBondContact O-N 2.78Å; E181-G183 VanDerWaalsContact O-N 3.08Å
182	N	87.5	Confident	93.4	Very high	97 Å²	97	66 Å²	66	52%	0.519	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.7	12.2	173.9	72.6	-6.9	0	0	0	113.6	D156 F180 T184	D156-N182 WeakPolarHBondContact OD2-CA 3.39Å; F180-N182 WeakPolarHBondContact CB-OD1 3.5Å; F180-N182 PolarHBondContact O-N 2.84Å; N182-T184 VanDerWaalsContact C-N 3.33Å; N182-T184 PolarHBondContact ND2-OG1 2.72Å; N182-T184 PolarHBondContact O-N 3.29Å; N182-T184 WeakPolarHBondContact OD1-CB 3.31Å; N182-T184 PolarHBondContact OD1-N 3.42Å; N182-T184 PolarHBondContact OD1-OG1 2.98Å
183	G	89.3	Confident	93.3	Very high	0 Å²	0	64.3 Å²	64.3	0%	0	33%	0.334	C	S	.	.	S	Bend	trans	74.8	14.2	-179.4	0	0	0	0	0	115.4	C153 W164 F180 E181	C153-G183 WeakPolarHBondContact CB-O 3.06Å; C153-G183 PolarHBondContact N-O 2.85Å; W164-G183 WeakPolarHBondContact CZ2-O 3.3Å; W164-G183 PolarHBondContact NE1-O 3.02Å; W164-G183 VanDerWaalsContact NE1-O 3.13Å; F180-G183 PolarHBondContact O-N 3.39Å; E181-G183 PolarHBondContact O-N 2.78Å; E181-G183 VanDerWaalsContact O-N 3.08Å
184	T	92.3	Very high	93.2	Very high	5 Å²	5	61.2 Å²	61.2	3%	0.031	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	135	176.3	-54.6	0	0	0	0	111.4	E150 F151 H152 F180 N182	E150-T184 HydrophobicContact CG-CG2 3.96Å; F151-T184 CarbonylContact O-C 3.52Å; F151-T184 WeakPolarHBondContact O-CA 3.41Å; H152-T184 WeakPolarHBondContact ND1-CG2 3.43Å; H152-T184 PolarHBondContact ND1-OG1 2.87Å; F180-T184 HydrophobicContact CD2-CG2 4.1Å; F180-T184 PolarHBondContact N-O 3.48Å; N182-T184 VanDerWaalsContact C-N 3.33Å; N182-T184 PolarHBondContact ND2-OG1 2.72Å; N182-T184 PolarHBondContact O-N 3.29Å; N182-T184 WeakPolarHBondContact OD1-CB 3.31Å; N182-T184 PolarHBondContact OD1-N 3.42Å; N182-T184 PolarHBondContact OD1-OG1 2.98Å
185	L	95.4	Very high	93	Very high	0 Å²	0	58.8 Å²	58.8	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	132.8	166.2	176.5	156.2	0	0	0	108.9	I149 E150 F151 W164 L171 L179 I187 Y198	I149-L185 HydrophobicContact CG2-CD2 4.41Å; E150-L185 WeakPolarHBondContact CA-O 3.49Å; F151-L185 HydrophobicContact CD2-CD2 4.26Å; F151-L185 PolarHBondContact N-O 2.78Å; F151-L185 PolarHBondContact O-N 2.82Å; W164-L185 HydrophobicContact CB-CD1 4.16Å; W164-L185 HydrophobicContact CD2-CB 3.79Å; W164-L185 HydrophobicContact CD2-CD1 3.75Å; W164-L185 HydrophobicContact CD2-CG 4.45Å; W164-L185 HydrophobicContact CE3-CB 4.13Å; W164-L185 HydrophobicContact CE3-CD1 3.64Å; W164-L185 HydrophobicContact CG-CB 4.27Å; W164-L185 HydrophobicContact CG-CD1 4.01Å; W164-L185 HydrophobicContact CH2-CB 4.16Å; W164-L185 HydrophobicContact CZ2-CB 3.81Å; W164-L185 HydrophobicContact CZ3-CB 4.3Å; W164-L185 HydrophobicContact CZ3-CD1 4.24Å; L171-L185 HydrophobicContact CD1-CD1 3.46Å; L171-L185 VanDerWaalsContact CD1-CD1 3.46Å; L179-L185 HydrophobicContact CD2-CB 4.07Å; L179-L185 HydrophobicContact CD2-CD1 3.99Å; L179-L185 HydrophobicContact CD2-CG 3.93Å; L185-I187 HydrophobicContact CD2-CD1 4.3Å; L185-I187 HydrophobicContact CD2-CG1 4.12Å; L185-Y198 HydrophobicContact CD1-CD1 3.63Å; L185-Y198 HydrophobicContact CD1-CE1 3.95Å; L185-Y198 HydrophobicContact CD2-CD1 4.4Å; L185-Y198 HydrophobicContact CD2-CE1 4.29Å
186	F	96.1	Very high	92.9	Very high	56 Å²	56	50.5 Å²	50.5	25%	0.246	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	124.9	179.4	-176.8	-115.8	0	0	0	113.1	P148 I149 E150 N178 F180 P188	P148-F186 HydrophobicContact CB-CE2 3.9Å; P148-F186 HydrophobicContact CB-CZ 4.3Å; I149-F186 CarbonylContact O-C 3.6Å; I149-F186 VanDerWaalsContact O-CA 3.31Å; I149-F186 WeakPolarHBondContact O-CA 3.24Å; E150-F186 HydrophobicContact CB-CD2 3.95Å; E150-F186 HydrophobicContact CB-CE2 4.5Å; E150-F186 HydrophobicContact CG-CD2 4.1Å; N178-F186 HydrophobicContact CB-CB 4.33Å; N178-F186 WeakPolarHBondContact CB-O 3.33Å; N178-F186 PolarHBondContact N-O 2.88Å; N178-F186 PolarHBondContact ND2-O 2.75Å; N178-F186 PolarHBondContact O-N 2.86Å; F180-F186 HydrophobicContact CD2-CB 4.49Å; F180-F186 HydrophobicContact CE2-CB 3.73Å; F186-P188 HydrophobicContact CD1-CG 4.04Å; F186-P188 HydrophobicContact CE1-CB 3.97Å; F186-P188 HydrophobicContact CE1-CG 3.66Å; F186-P188 HydrophobicContact CZ-CB 4.29Å; F186-P188 HydrophobicContact CZ-CG 4.43Å
187	I	96.7	Very high	92.6	Very high	0 Å²	0	47 Å²	47	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	109.6	172	-57.5	173.9	0	0	0	107.3	P148 I149 H176 V177 L185 K189 D194 Y198	P148-I187 CarbonylContact C-O 3.57Å; P148-I187 VanDerWaalsContact CA-O 3.28Å; P148-I187 WeakPolarHBondContact CA-O 3.49Å; I149-I187 HydrophobicContact CB-CB 4.09Å; I149-I187 HydrophobicContact CB-CD1 4.5Å; I149-I187 HydrophobicContact CD1-CB 4.44Å; I149-I187 HydrophobicContact CD1-CD1 4.08Å; I149-I187 PolarHBondContact N-O 2.89Å; I149-I187 PolarHBondContact O-N 3.21Å; H176-I187 VanDerWaalsContact CE1-CG2 3.49Å; H176-I187 WeakPolarHBondContact CE1-CG2 3.38Å; V177-I187 HydrophobicContact CG2-CD1 4.27Å; V177-I187 HydrophobicContact CG2-CG1 4.19Å; L185-I187 HydrophobicContact CD2-CD1 4.3Å; L185-I187 HydrophobicContact CD2-CG1 4.12Å; I187-K189 VanDerWaalsContact C-N 3.27Å; I187-K189 PolarHBondContact O-N 2.6Å; I187-D194 HydrophobicContact CD1-CB 4.47Å; I187-Y198 HydrophobicContact CD1-CE1 4.26Å; I187-Y198 WeakPolarHBondContact CD1-OH 3.33Å
188	P	94.2	Very high	92.3	Very high	56 Å²	56	46.5 Å²	46.5	36%	0.364	23%	0.231	S	C	.	.	S	Bend	trans	-64	-30.4	-173.2	-21	29.5	0	0	0	114.3	F186	F186-P188 HydrophobicContact CD1-CG 4.04Å; F186-P188 HydrophobicContact CE1-CB 3.97Å; F186-P188 HydrophobicContact CE1-CG 3.66Å; F186-P188 HydrophobicContact CZ-CB 4.29Å; F186-P188 HydrophobicContact CZ-CG 4.43Å
189	K	93.3	Very high	92	Very high	147 Å²	147	44.2 Å²	44.2	64%	0.639	22%	0.218	S	C	*	.	S	Bend	trans	-133.3	84	-177.4	-66.4	-176.6	-178	179	0	109.6	I187	I187-K189 VanDerWaalsContact C-N 3.27Å; I187-K189 PolarHBondContact O-N 2.6Å
190	G	92.8	Very high	91.8	Very high	6 Å²	6	41.8 Å²	41.8	6%	0.062	21%	0.206	C	C	.	.			trans	-61.2	143.4	174.2	0	0	0	0	0	111.8	I147	I147-G190 WeakPolarHBondContact O-CA 3.39Å; I147-G190 PolarHBondContact O-N 3Å
191	S	92.6	Very high	91.6	Very high	47 Å²	47	38 Å²	38	33%	0.329	19%	0.19	S	C	.	.			trans	-135.8	165.6	178.8	73.8	0	0	0	0	110	L141 K193 D194	L141-S191 WeakPolarHBondContact CD1-O 3.43Å; S191-K193 PolarHBondContact O-N 3.09Å; S191-K193 PolarHBondContact OG-N 2.97Å; S191-D194 WeakPolarHBondContact CA-OD2 3.2Å; S191-D194 WeakPolarHBondContact CB-OD2 3.26Å; S191-D194 PolarHBondContact N-OD2 2.92Å; S191-D194 WeakPolarHBondContact O-CA 3.2Å; S191-D194 VanDerWaalsContact O-CB 3.3Å; S191-D194 WeakPolarHBondContact O-CB 3.48Å; S191-D194 PolarHBondContact O-N 2.81Å; S191-D194 PolarHBondContact OG-OD2 3.24Å
192	I	91.2	Very high	91.5	Very high	24 Å²	24	29 Å²	29	12%	0.123	15%	0.148	C	C	.	.	G	3₁₀ helix	trans	-60.1	-20.2	177.6	-157.3	75.8	0	0	0	113.3	D194 C195 K216 T218 L220	I192-D194 PolarHBondContact O-N 2.97Å; I192-C195 VanDerWaalsContact CD1-SG 3.57Å; I192-C195 WeakPolarHBondContact O-CB 3.3Å; I192-C195 PolarHBondContact O-N 3.2Å; I192-K216 WeakPolarHBondContact CD1-O 3.22Å; I192-T218 HydrophobicContact CG2-CG2 4.39Å; I192-L220 HydrophobicContact CG2-CD1 3.92Å; I192-L220 HydrophobicContact CG2-CD2 3.78Å; I192-L220 HydrophobicContact CG2-CG 4.07Å
193	K	91.3	Very high	91.2	Very high	116 Å²	116	27.9 Å²	27.9	50%	0.504	15%	0.145	S	C	.	.	G	3₁₀ helix	trans	-70.1	-21	173.9	-61.6	-175.6	-178.7	-178.6	0	112.9	S191 L220 Y242	S191-K193 PolarHBondContact O-N 3.09Å; S191-K193 PolarHBondContact OG-N 2.97Å; K193-L220 HydrophobicContact CD-CD1 4.01Å; K193-L220 HydrophobicContact CG-CD1 3.52Å; K193-Y242 HydrophobicContact CB-CD1 4.26Å; K193-Y242 HydrophobicContact CB-CE1 4.25Å; K193-Y242 HydrophobicContact CG-CD1 4.18Å; K193-Y242 HydrophobicContact CG-CE1 4.04Å; K193-Y242 HydrophobicContact CG-CG 4.47Å
194	D	93.2	Very high	90.7	Very high	13 Å²	13	31 Å²	31	7%	0.07	17%	0.167	C	C	.	.	G	3₁₀ helix	trans	-87.9	-7.8	177.7	-53.8	-58.9	0	0	0	111.7	I149 H166 H176 I187 S191 I192 G196 Y198	I149-D194 HydrophobicContact CD1-CB 3.65Å; H166-D194 PolarHBondContact NE2-O 2.84Å; H176-D194 IonicContact CD2-OD1 3.46Å; H176-D194 IonicContact CE1-OD1 3.6Å; H176-D194 IonicContact CE1-OD2 3.97Å; H176-D194 IonicContact NE2-OD1 3.47Å; H176-D194 PolarHBondContact NE2-OD1 3.06Å; H176-D194 IonicContact NE2-OD2 3.17Å; H176-D194 PolarHBondContact NE2-OD2 2.82Å; I187-D194 HydrophobicContact CD1-CB 4.47Å; S191-D194 WeakPolarHBondContact CA-OD2 3.2Å; S191-D194 WeakPolarHBondContact CB-OD2 3.26Å; S191-D194 PolarHBondContact N-OD2 2.92Å; S191-D194 WeakPolarHBondContact O-CA 3.2Å; S191-D194 VanDerWaalsContact O-CB 3.3Å; S191-D194 WeakPolarHBondContact O-CB 3.48Å; S191-D194 PolarHBondContact O-N 2.81Å; S191-D194 PolarHBondContact OG-OD2 3.24Å; I192-D194 PolarHBondContact O-N 2.97Å; D194-G196 PolarHBondContact O-N 2.82Å; D194-Y198 VanDerWaalsContact O-CE2 3.32Å; D194-Y198 WeakPolarHBondContact O-CE2 3.18Å; D194-Y198 PolarHBondContact O-OH 2.87Å; D194-Y198 VanDerWaalsContact O-OH 3.07Å
195	C	92	Very high	89.7	Confident	6 Å²	6	33.8 Å²	33.8	4%	0.041	18%	0.182	C	C	.	.			trans	-59.7	138.6	170.9	-71.2	0	0	0	0	110.8	I192 V213 H244	I192-C195 VanDerWaalsContact CD1-SG 3.57Å; I192-C195 WeakPolarHBondContact O-CB 3.3Å; I192-C195 PolarHBondContact O-N 3.2Å; C195-V213 CarbonylContact C-O 3.53Å; C195-V213 VanDerWaalsContact CA-O 3.25Å; C195-V213 WeakPolarHBondContact CA-O 3.26Å; C195-V213 WeakPolarHBondContact CB-O 3.26Å; C195-H244 HydrophobicContact CB-CB 4.01Å
196	G	90.4	Very high	88.7	Confident	0 Å²	0	41.8 Å²	41.8	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	150.5	-166.4	-176.9	0	0	0	0	0	111.8	D167 D194 V213	D167-G196 WeakPolarHBondContact OD1-CA 3.28Å; D194-G196 PolarHBondContact O-N 2.82Å; G196-V213 PolarHBondContact N-O 3.48Å; G196-V213 PolarHBondContact O-N 3.42Å
197	V	89.2	Confident	87.8	Confident	2 Å²	2	44.2 Å²	44.2	1%	0.012	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	124.8	-179.6	-175.6	0	0	0	0	109.1	Y38 H166 D167 V210	Y38-V197 HydrophobicContact CD2-CB 3.97Å; Y38-V197 HydrophobicContact CD2-CG1 3.46Å; Y38-V197 VanDerWaalsContact CD2-CG1 3.46Å; Y38-V197 HydrophobicContact CD2-CG2 4.39Å; Y38-V197 HydrophobicContact CE2-CB 4Å; Y38-V197 HydrophobicContact CE2-CG1 3.78Å; Y38-V197 HydrophobicContact CG-CG1 3.94Å; H166-V197 WeakPolarHBondContact CA-O 3.42Å; D167-V197 PolarHBondContact N-O 3.31Å; D167-V197 PolarHBondContact OD1-N 2.78Å; V197-V210 HydrophobicContact CG1-CG1 3.38Å
198	Y	91.9	Very high	87.3	Confident	2 Å²	2	44.3 Å²	44.3	1%	0.008	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	140.1	172.8	-69.4	-100.1	0	0	0	109.2	F151 F165 H166 L171 L185 I187 D194 V210 F211 V213	F151-Y198 HydrophobicContact CD2-CG 4.22Å; F151-Y198 AromaticContact CE2-CD2 3.78Å; F151-Y198 HydrophobicContact CE2-CD2 3.78Å; F151-Y198 HydrophobicContact CE2-CE2 4.38Å; F151-Y198 AromaticContact CE2-CG 3.92Å; F151-Y198 HydrophobicContact CE2-CG 3.92Å; F165-Y198 CarbonylContact O-C 3.56Å; F165-Y198 VanDerWaalsContact O-CA 3.31Å; F165-Y198 WeakPolarHBondContact O-CA 3.49Å; H166-Y198 HydrophobicContact CB-CD1 4.07Å; H166-Y198 HydrophobicContact CB-CE1 3.9Å; H166-Y198 AromaticContact CD2-CD2 3.9Å; H166-Y198 AromaticContact CD2-CE1 3.71Å; H166-Y198 AromaticContact CD2-CE2 3.46Å; H166-Y198 VanDerWaalsContact CD2-CE2 3.46Å; H166-Y198 WeakPolarHBondContact CD2-CE2 3.28Å; H166-Y198 AromaticContact CD2-CZ 3.36Å; H166-Y198 AromaticContact CG-CE1 3.89Å; H166-Y198 AromaticContact CG-CZ 3.91Å; H166-Y198 AromaticContact NE2-CE2 3.8Å; H166-Y198 AromaticContact NE2-CZ 3.74Å; L171-Y198 HydrophobicContact CD1-CD1 4.05Å; L171-Y198 HydrophobicContact CD1-CE1 4Å; L185-Y198 HydrophobicContact CD1-CD1 3.63Å; L185-Y198 HydrophobicContact CD1-CE1 3.95Å; L185-Y198 HydrophobicContact CD2-CD1 4.4Å; L185-Y198 HydrophobicContact CD2-CE1 4.29Å; I187-Y198 HydrophobicContact CD1-CE1 4.26Å; I187-Y198 WeakPolarHBondContact CD1-OH 3.33Å; D194-Y198 VanDerWaalsContact O-CE2 3.32Å; D194-Y198 WeakPolarHBondContact O-CE2 3.18Å; D194-Y198 PolarHBondContact O-OH 2.87Å; D194-Y198 VanDerWaalsContact O-OH 3.07Å; Y198-V210 CarbonylContact O-C 3.59Å; Y198-V210 WeakPolarHBondContact O-CA 3.32Å; Y198-F211 PolarHBondContact N-O 2.93Å; Y198-F211 PolarHBondContact O-N 3.13Å; Y198-V213 HydrophobicContact CD2-CB 4.46Å; Y198-V213 HydrophobicContact CD2-CG2 3.72Å; Y198-V213 HydrophobicContact CE2-CB 3.99Å; Y198-V213 HydrophobicContact CE2-CG2 3.39Å
199	M	89.5	Confident	86.9	Confident	0 Å²	0	42 Å²	42	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	131.4	176.8	180	-171	63.9	0	0	109.6	Y38 Y127 W164 F165 Q201 S208 A209 V210	Y38-M199 HydrophobicContact CD1-SD 4.06Å; Y38-M199 HydrophobicContact CE1-CB 4.02Å; Y38-M199 HydrophobicContact CE1-CE 4.22Å; Y38-M199 HydrophobicContact CE1-CG 4.29Å; Y38-M199 HydrophobicContact CE1-SD 3.59Å; Y38-M199 VanDerWaalsContact CE1-SD 3.59Å; Y127-M199 HydrophobicContact CD1-CE 4.13Å; Y127-M199 HydrophobicContact CD1-SD 3.67Å; Y127-M199 HydrophobicContact CD2-SD 4.33Å; Y127-M199 HydrophobicContact CE1-CE 3.87Å; Y127-M199 HydrophobicContact CE1-SD 4.05Å; Y127-M199 HydrophobicContact CE2-CE 4.49Å; Y127-M199 HydrophobicContact CG-SD 3.81Å; W164-M199 CarbonylContact C-O 3.59Å; W164-M199 WeakPolarHBondContact CA-O 3.44Å; F165-M199 HydrophobicContact CB-CB 4.36Å; F165-M199 HydrophobicContact CB-CE 4.04Å; F165-M199 HydrophobicContact CD1-CE 4.44Å; F165-M199 HydrophobicContact CD2-CE 3.43Å; F165-M199 VanDerWaalsContact CD2-CE 3.43Å; F165-M199 HydrophobicContact CE2-CE 3.97Å; F165-M199 HydrophobicContact CG-CE 3.72Å; F165-M199 PolarHBondContact N-O 3.19Å; F165-M199 PolarHBondContact O-N 2.85Å; M199-Q201 HydrophobicContact CE-CB 4.46Å; M199-S208 VanDerWaalsContact SD-CB 3.56Å; M199-A209 CarbonylContact C-O 3.56Å; M199-A209 VanDerWaalsContact CA-O 3.3Å; M199-A209 WeakPolarHBondContact CA-O 3.45Å; M199-A209 WeakPolarHBondContact CG-O 3.43Å; M199-V210 HydrophobicContact CB-CG2 4.48Å; M199-V210 HydrophobicContact CG-CG2 4.25Å
200	C	90.6	Very high	86.6	Confident	0 Å²	0	35.2 Å²	35.2	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	134.8	162.6	78.1	0	0	0	0	110	C153 R163 W164 S208 A209 F211	C153-C200 VanDerWaalsContact CA-SG 3.54Å; C153-C200 HydrophobicContact CB-CB 3.62Å; C153-C200 WeakPolarHBondContact CB-SG 3.5Å; C153-C200 WeakPolarHBondContact SG-CB 3.42Å; C153-C200 CovalentContact SG-SG 2.03Å; C153-C200 PolarHBondContact SG-SG 2.6Å; R163-C200 CarbonylContact O-C 3.59Å; R163-C200 WeakPolarHBondContact O-CA 3.19Å; W164-C200 HydrophobicContact CD2-CB 3.85Å; W164-C200 HydrophobicContact CE3-CB 3.87Å; W164-C200 HydrophobicContact CH2-CB 3.85Å; W164-C200 HydrophobicContact CZ2-CB 3.83Å; W164-C200 HydrophobicContact CZ3-CB 3.87Å; C200-S208 CarbonylContact O-C 3.49Å; C200-S208 VanDerWaalsContact O-CA 3.28Å; C200-S208 WeakPolarHBondContact O-CA 3.25Å; C200-A209 PolarHBondContact N-O 2.9Å; C200-A209 PolarHBondContact O-N 3.16Å; C200-F211 HydrophobicContact CB-CE2 4.33Å
201	Q	87.1	Confident	86.5	Confident	25 Å²	25	35.2 Å²	35.2	12%	0.117	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	129.4	177.5	-174.7	-177	62.3	0	0	109.7	V162 R163 F165 M199 T203	V162-Q201 WeakPolarHBondContact CA-O 3.29Å; R163-Q201 PolarHBondContact N-O 3.4Å; R163-Q201 PolarHBondContact O-N 3.17Å; F165-Q201 HydrophobicContact CE2-CB 4.1Å; M199-Q201 HydrophobicContact CE-CB 4.46Å; Q201-T203 PolarHBondContact O-N 2.89Å
202	A	84.3	Confident	86.3	Confident	6 Å²	6	34.3 Å²	34.3	5%	0.05	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68	132.1	173.1	0	0	0	0	0	110.2	L155 S204 D205 R207	L155-A202 HydrophobicContact CB-CB 4.24Å; L155-A202 HydrophobicContact CD1-CB 4.39Å; A202-S204 PolarHBondContact O-N 2.75Å; A202-D205 HydrophobicContact CB-CB 4.35Å; A202-D205 PolarHBondContact O-N 3.26Å; A202-R207 PolarHBondContact N-O 2.74Å
203	T	82.7	Confident	86.4	Confident	74 Å²	74	33.1 Å²	33.1	45%	0.454	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-31.3	178.7	47.6	0	0	0	0	113.7	S161 R163 Q201	S161-T203 WeakPolarHBondContact O-CB 2.89Å; S161-T203 WeakPolarHBondContact O-CG2 3.43Å; S161-T203 PolarHBondContact O-N 3.16Å; S161-T203 PolarHBondContact O-OG1 2.98Å; R163-T203 HydrophobicContact CG-CG2 4.01Å; Q201-T203 PolarHBondContact O-N 2.89Å
204	S	77.2	Confident	86.4	Confident	67 Å²	67	29.6 Å²	29.6	47%	0.469	14%	0.143	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.5	-4.3	-174.7	67.4	0	0	0	0	115.4	K160 A202	K160-S204 WeakPolarHBondContact CD-OG 3.43Å; K160-S204 WeakPolarHBondContact CE-OG 3.36Å; K160-S204 PolarHBondContact NZ-OG 3.34Å; A202-S204 PolarHBondContact O-N 2.75Å
205	D	72.3	Confident	86.4	Confident	63 Å²	63	29 Å²	29	34%	0.337	14%	0.141	S	C	.	.	S	Bend	trans	-149.1	160.4	-169	-162.4	-20.6	0	0	0	110.2	A202 R207	A202-D205 HydrophobicContact CB-CB 4.35Å; A202-D205 PolarHBondContact O-N 3.26Å; D205-R207 VanDerWaalsContact C-N 3.28Å; D205-R207 IonicContact OD2-CZ 3.28Å; D205-R207 IonicContact OD2-NE 2.72Å; D205-R207 PolarHBondContact OD2-NE 3.07Å; D205-R207 IonicContact OD2-NH2 3.88Å; D205-R207 PolarHBondContact OD2-NH2 3.37Å
206	R	74.5	Confident	86.5	Confident	168 Å²	168	31.5 Å²	31.5	63%	0.634	15%	0.151	S	C	*	.	S	Bend	trans	-82.1	-4.8	176.2	-67.6	-172.6	176.5	-166.4	-3.6	113.3
207	R	77.5	Confident	86.7	Confident	107 Å²	107	31.5 Å²	31.5	40%	0.404	15%	0.151	S	C	.	.			trans	-66.7	142	179.2	-71.2	-176.3	-72.9	166.1	-4.1	112.3	L155 A202 D205	L155-R207 HydrophobicContact CD1-CB 4.2Å; L155-R207 VanDerWaalsContact CD1-O 3.31Å; L155-R207 WeakPolarHBondContact CD1-O 3.36Å; L155-R207 HydrophobicContact CD2-CB 4.24Å; A202-R207 PolarHBondContact N-O 2.74Å; D205-R207 VanDerWaalsContact C-N 3.28Å; D205-R207 IonicContact OD2-CZ 3.28Å; D205-R207 IonicContact OD2-NE 2.72Å; D205-R207 PolarHBondContact OD2-NE 3.07Å; D205-R207 IonicContact OD2-NH2 3.88Å; D205-R207 PolarHBondContact OD2-NH2 3.37Å
208	S	85.4	Confident	86.9	Confident	1 Å²	1	31.9 Å²	31.9	1%	0.007	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134	147.3	177.7	33.6	0	0	0	0	111	T128 H130 M199 C200	T128-S208 PolarHBondContact O-OG 3.46Å; H130-S208 WeakPolarHBondContact CB-O 3.43Å; H130-S208 PolarHBondContact N-O 2.94Å; M199-S208 VanDerWaalsContact SD-CB 3.56Å; C200-S208 CarbonylContact O-C 3.49Å; C200-S208 VanDerWaalsContact O-CA 3.28Å; C200-S208 WeakPolarHBondContact O-CA 3.25Å
209	A	86	Confident	87.1	Confident	7 Å²	7	32 Å²	32	6%	0.058	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	142.6	164.4	0	0	0	0	0	108.9	P154 M199 C200 F211	P154-A209 HydrophobicContact CG-CB 3.66Å; M199-A209 CarbonylContact C-O 3.56Å; M199-A209 VanDerWaalsContact CA-O 3.3Å; M199-A209 WeakPolarHBondContact CA-O 3.45Å; M199-A209 WeakPolarHBondContact CG-O 3.43Å; C200-A209 PolarHBondContact N-O 2.9Å; C200-A209 PolarHBondContact O-N 3.16Å; A209-F211 HydrophobicContact CB-CE2 4.13Å; A209-F211 HydrophobicContact CB-CZ 4.23Å
210	V	86.8	Confident	87.1	Confident	5 Å²	5	35.5 Å²	35.5	3%	0.03	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	141.3	-172.4	177.5	0	0	0	0	108.9	Y38 R129 V197 Y198 M199	Y38-V210 HydrophobicContact CD1-CG2 4Å; Y38-V210 HydrophobicContact CG-CG1 4.46Å; Y38-V210 HydrophobicContact CG-CG2 4.32Å; R129-V210 HydrophobicContact CG-CB 4.06Å; R129-V210 HydrophobicContact CG-CG2 3.77Å; V197-V210 HydrophobicContact CG1-CG1 3.38Å; Y198-V210 CarbonylContact O-C 3.59Å; Y198-V210 WeakPolarHBondContact O-CA 3.32Å; M199-V210 HydrophobicContact CB-CG2 4.48Å; M199-V210 HydrophobicContact CG-CG2 4.25Å
211	F	89.9	Confident	87.1	Confident	7 Å²	7	40.8 Å²	40.8	3%	0.031	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	153.1	-178.2	-47.7	-99.7	0	0	0	108.2	P137 F151 H152 W164 Y198 C200 A209	P137-F211 HydrophobicContact CB-CD1 3.85Å; P137-F211 HydrophobicContact CB-CE1 4.41Å; P137-F211 HydrophobicContact CG-CD1 3.66Å; P137-F211 HydrophobicContact CG-CE1 3.86Å; P137-F211 WeakPolarHBondContact O-CA 2.65Å; F151-F211 HydrophobicContact CB-CD1 3.91Å; F151-F211 HydrophobicContact CB-CD2 4.48Å; F151-F211 HydrophobicContact CB-CE1 4.04Å; F151-F211 HydrophobicContact CB-CG 4.15Å; F151-F211 HydrophobicContact CB-CZ 4.41Å; F151-F211 HydrophobicContact CD1-CB 3.8Å; F151-F211 AromaticContact CD1-CD1 3.44Å; F151-F211 HydrophobicContact CD1-CD1 3.44Å; F151-F211 VanDerWaalsContact CD1-CD1 3.44Å; F151-F211 HydrophobicContact CD1-CE1 4.24Å; F151-F211 AromaticContact CD1-CG 3.82Å; F151-F211 HydrophobicContact CD1-CG 3.82Å; F151-F211 HydrophobicContact CD2-CB 3.9Å; F151-F211 HydrophobicContact CD2-CG 4.15Å; F151-F211 HydrophobicContact CE1-CB 3.67Å; F151-F211 HydrophobicContact CE1-CD1 4.03Å; F151-F211 HydrophobicContact CE1-CG 4.21Å; F151-F211 HydrophobicContact CE2-CB 3.78Å; F151-F211 HydrophobicContact CG-CB 3.92Å; F151-F211 AromaticContact CG-CD1 3.73Å; F151-F211 HydrophobicContact CG-CD1 3.73Å; F151-F211 HydrophobicContact CG-CD2 4.47Å; F151-F211 HydrophobicContact CG-CE1 4.37Å; F151-F211 AromaticContact CG-CG 3.8Å; F151-F211 HydrophobicContact CG-CG 3.8Å; F151-F211 HydrophobicContact CZ-CB 3.66Å; H152-F211 WeakPolarHBondContact O-CZ 3.3Å; W164-F211 AromaticContact CH2-CD2 3.79Å; W164-F211 HydrophobicContact CH2-CD2 3.79Å; W164-F211 AromaticContact CH2-CE2 3.33Å; W164-F211 HydrophobicContact CH2-CE2 3.33Å; W164-F211 AromaticContact CH2-CZ 3.79Å; W164-F211 HydrophobicContact CH2-CZ 3.79Å; W164-F211 HydrophobicContact CZ2-CE2 4.48Å; W164-F211 AromaticContact CZ3-CD2 3.56Å; W164-F211 HydrophobicContact CZ3-CD2 3.56Å; W164-F211 AromaticContact CZ3-CE2 3.51Å; W164-F211 HydrophobicContact CZ3-CE2 3.51Å; W164-F211 HydrophobicContact CZ3-CG 4.5Å; W164-F211 HydrophobicContact CZ3-CZ 4.4Å; Y198-F211 PolarHBondContact N-O 2.93Å; Y198-F211 PolarHBondContact O-N 3.13Å; C200-F211 HydrophobicContact CB-CE2 4.33Å; A209-F211 HydrophobicContact CB-CE2 4.13Å; A209-F211 HydrophobicContact CB-CZ 4.23Å
212	Q	89.7	Confident	87.4	Confident	27 Å²	27	42.8 Å²	42.8	13%	0.126	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	133.5	-177.4	-61.2	-175.9	20	0	0	110.7	D136 P137 T138 I139 R214 H244	D136-Q212 HydrophobicContact CB-CG 4.41Å; D136-Q212 PolarHBondContact OD2-NE2 2.93Å; P137-Q212 PolarHBondContact O-N 2.72Å; T138-Q212 CarbonylContact C-O 3.54Å; T138-Q212 VanDerWaalsContact CA-O 3.28Å; T138-Q212 WeakPolarHBondContact CA-O 2.95Å; T138-Q212 HydrophobicContact CG2-CB 4.46Å; I139-Q212 PolarHBondContact N-O 3.44Å; Q212-R214 HydrophobicContact CB-CG 4.34Å; Q212-H244 PolarHBondContact OE1-NE2 2.82Å
213	V	92.7	Very high	87.8	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	106.7	165.7	-179	0	0	0	0	106.7	I139 L141 I149 F151 C195 G196 Y198 H244	I139-V213 HydrophobicContact CB-CG2 4.5Å; I139-V213 CarbonylContact O-C 3.49Å; I139-V213 WeakPolarHBondContact O-CA 3.07Å; L141-V213 HydrophobicContact CD1-CG1 3.55Å; L141-V213 HydrophobicContact CD2-CG1 4.42Å; L141-V213 HydrophobicContact CG-CG1 3.66Å; I149-V213 HydrophobicContact CD1-CG1 3.95Å; I149-V213 HydrophobicContact CD1-CG2 4.08Å; I149-V213 HydrophobicContact CG1-CG1 4.49Å; I149-V213 HydrophobicContact CG1-CG2 4.39Å; I149-V213 HydrophobicContact CG2-CG2 3.81Å; F151-V213 HydrophobicContact CE2-CG2 3.68Å; F151-V213 HydrophobicContact CZ-CG2 3.64Å; C195-V213 CarbonylContact C-O 3.53Å; C195-V213 VanDerWaalsContact CA-O 3.25Å; C195-V213 WeakPolarHBondContact CA-O 3.26Å; C195-V213 WeakPolarHBondContact CB-O 3.26Å; G196-V213 PolarHBondContact N-O 3.48Å; G196-V213 PolarHBondContact O-N 3.42Å; Y198-V213 HydrophobicContact CD2-CB 4.46Å; Y198-V213 HydrophobicContact CD2-CG2 3.72Å; Y198-V213 HydrophobicContact CE2-CB 3.99Å; Y198-V213 HydrophobicContact CE2-CG2 3.39Å; V213-H244 VanDerWaalsContact O-CB 3.29Å; V213-H244 WeakPolarHBondContact O-CB 3.14Å
214	R	92.6	Very high	88	Confident	41 Å²	41	48.8 Å²	48.8	16%	0.155	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	152.3	-174.8	-73.1	170.7	64.1	97.6	-1	110.9	T138 I139 E140 L141 Q212 H244 E298 I299	T138-R214 HydrophobicContact CG2-CB 4.43Å; T138-R214 HydrophobicContact CG2-CG 4.02Å; I139-R214 PolarHBondContact O-N 3.1Å; E140-R214 WeakPolarHBondContact CA-O 3.42Å; E140-R214 HydrophobicContact CG-CB 4.36Å; L141-R214 PolarHBondContact N-O 3.35Å; Q212-R214 HydrophobicContact CB-CG 4.34Å; R214-H244 CarbonylContact C-O 3.59Å; R214-H244 VanDerWaalsContact CA-O 3.24Å; R214-H244 WeakPolarHBondContact CA-O 3.36Å; R214-H244 WeakPolarHBondContact CB-O 3.1Å; R214-E298 IonicContact CZ-OE1 2.66Å; R214-E298 IonicContact NH1-OE1 3.56Å; R214-E298 PolarHBondContact NH1-OE1 3.08Å; R214-E298 IonicContact NH2-OE1 2.62Å; R214-E298 PolarHBondContact NH2-OE1 2.84Å; R214-I299 HydrophobicContact CB-CD1 3.83Å
215	G	92.8	Very high	88.7	Confident	2 Å²	2	48.5 Å²	48.5	2%	0.021	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-176.9	153.5	179.8	0	0	0	0	0	110.9	H244 N297	G215-H244 PolarHBondContact N-O 3.11Å; G215-H244 PolarHBondContact O-N 2.71Å; G215-H244 VanDerWaalsContact O-N 3.09Å; G215-H244 VanDerWaalsContact O-O 3.05Å; G215-N297 PolarHBondContact O-ND2 3.09Å
216	K	93.6	Very high	89.7	Confident	58 Å²	58	47.3 Å²	47.3	25%	0.252	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-64	152.5	-178.3	67.2	167.3	-179.1	164.7	0	112.4	E143 I192 T218 I299	E143-K216 WeakPolarHBondContact OE1-CE 3.5Å; E143-K216 IonicContact OE1-NZ 3.34Å; E143-K216 PolarHBondContact OE1-NZ 2.94Å; E143-K216 WeakPolarHBondContact OE2-CE 3.38Å; E143-K216 IonicContact OE2-NZ 3.7Å; E143-K216 PolarHBondContact OE2-NZ 2.9Å; I192-K216 WeakPolarHBondContact CD1-O 3.22Å; K216-T218 PolarHBondContact O-N 3.06Å; K216-T218 PolarHBondContact O-OG1 3.48Å; K216-I299 HydrophobicContact CB-CB 4.27Å; K216-I299 HydrophobicContact CB-CG2 3.95Å
217	A	94.2	Very high	90.7	Very high	0 Å²	0	43 Å²	43	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-56.8	123.8	172.3	0	0	0	0	0	110	Y242 P247 A295 N297 D302	A217-Y242 CarbonylContact C-O 3.58Å; A217-Y242 WeakPolarHBondContact CA-O 3.19Å; A217-P247 HydrophobicContact CB-CB 3.89Å; A217-P247 HydrophobicContact CB-CG 3.86Å; A217-A295 HydrophobicContact CB-CB 4.08Å; A217-N297 HydrophobicContact CB-CB 4.38Å; A217-N297 PolarHBondContact N-ND2 2.96Å; A217-N297 PolarHBondContact N-OD1 2.76Å; A217-N297 VanDerWaalsContact N-OD1 3.17Å; A217-D302 VanDerWaalsContact O-CB 3.24Å; A217-D302 WeakPolarHBondContact O-CB 3.31Å
218	T	94.4	Very high	91.5	Very high	10 Å²	10	41.6 Å²	41.6	6%	0.061	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	131.3	-173.8	-52.9	0	0	0	0	110.3	I192 K216 L220 V241 Y242	I192-T218 HydrophobicContact CG2-CG2 4.39Å; K216-T218 PolarHBondContact O-N 3.06Å; K216-T218 PolarHBondContact O-OG1 3.48Å; T218-L220 HydrophobicContact CG2-CD2 4.1Å; T218-V241 WeakPolarHBondContact O-CA 3.34Å; T218-Y242 PolarHBondContact N-O 3.22Å; T218-Y242 PolarHBondContact O-N 2.84Å
219	I	95.2	Very high	92	Very high	4 Å²	4	43.6 Å²	43.6	2%	0.021	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	104.7	177.1	-56.1	170.7	0	0	0	108.3	K222 A295 D302	I219-K222 HydrophobicContact CB-CD 4.14Å; I219-K222 HydrophobicContact CG2-CD 4.11Å; I219-K222 WeakPolarHBondContact O-CE 3.31Å; I219-A295 HydrophobicContact CD1-CB 4.21Å; I219-A295 HydrophobicContact CG1-CB 4.12Å; I219-D302 WeakPolarHBondContact CB-OD2 3.28Å; I219-D302 HydrophobicContact CG1-CB 4.46Å; I219-D302 PolarHBondContact N-OD2 2.97Å
220	L	89.6	Confident	92.4	Very high	73 Å²	73	46.6 Å²	46.6	38%	0.382	24%	0.238	S	C	.	.	S	Bend	trans	-76.9	-34.7	-175.3	-69.2	-178.4	0	0	0	113.2	I192 K193 T218 K222 H240 Y242	I192-L220 HydrophobicContact CG2-CD1 3.92Å; I192-L220 HydrophobicContact CG2-CD2 3.78Å; I192-L220 HydrophobicContact CG2-CG 4.07Å; K193-L220 HydrophobicContact CD-CD1 4.01Å; K193-L220 HydrophobicContact CG-CD1 3.52Å; T218-L220 HydrophobicContact CG2-CD2 4.1Å; L220-K222 PolarHBondContact O-N 2.85Å; L220-H240 PolarHBondContact N-O 3.45Å; L220-Y242 HydrophobicContact CB-CD2 4.44Å; L220-Y242 HydrophobicContact CB-CE2 4.47Å; L220-Y242 HydrophobicContact CD1-CD2 3.61Å; L220-Y242 HydrophobicContact CD1-CE2 3.75Å; L220-Y242 HydrophobicContact CD1-CG 4.33Å; L220-Y242 HydrophobicContact CG-CD2 3.91Å; L220-Y242 HydrophobicContact CG-CE2 4.29Å
221	E	90.3	Very high	92.8	Very high	111 Å²	111	49.6 Å²	49.6	52%	0.519	25%	0.252	S	S	.	.	S	Bend	trans	-103.2	70.3	-179.1	-63.5	176.5	-156.9	0	0	109.7	H240	E221-H240 HydrophobicContact CB-CB 4.13Å; E221-H240 HydrophobicContact CG-CB 4.41Å; E221-H240 IonicContact OE2-CD2 2.75Å; E221-H240 PolarHBondContact OE2-CD2 2.88Å; E221-H240 IonicContact OE2-CG 2.76Å; E221-H240 IonicContact OE2-NE2 2.77Å
222	K	92.7	Very high	93	Very high	68 Å²	68	50.4 Å²	50.4	30%	0.296	26%	0.262	S	S	.	.			trans	-55.5	143	176.6	-64.5	-64.8	-168.2	175.5	0	110.7	I219 L220 H224 D302 E303	I219-K222 HydrophobicContact CB-CD 4.14Å; I219-K222 HydrophobicContact CG2-CD 4.11Å; I219-K222 WeakPolarHBondContact O-CE 3.31Å; L220-K222 PolarHBondContact O-N 2.85Å; K222-H224 PolarHBondContact O-CD2 3.34Å; K222-H224 PolarHBondContact O-NE2 3.17Å; K222-D302 WeakPolarHBondContact CE-OD2 3.46Å; K222-D302 IonicContact NZ-OD1 2.6Å; K222-D302 PolarHBondContact NZ-OD1 2.87Å; K222-D302 IonicContact NZ-OD2 3.16Å; K222-D302 PolarHBondContact NZ-OD2 2.83Å; K222-E303 PolarHBondContact NZ-O 2.98Å
223	Y	93.8	Very high	93.3	Very high	33 Å²	33	52.1 Å²	52.1	13%	0.129	27%	0.272	C	S	.	.			trans	-71	141.8	174.3	-54.4	-43.5	0	0	0	110.2	I237 N238 C239 C293 S304 A305 V306	Y223-I237 HydrophobicContact CE1-CG2 4.16Å; Y223-I237 HydrophobicContact CE2-CG2 4.03Å; Y223-I237 WeakPolarHBondContact OH-CG2 3.49Å; Y223-N238 WeakPolarHBondContact CE1-O 3.33Å; Y223-N238 VanDerWaalsContact CZ-O 3.29Å; Y223-N238 PolarHBondContact OH-O 3.05Å; Y223-C239 WeakPolarHBondContact OH-CA 3.32Å; Y223-C239 PolarHBondContact OH-N 2.86Å; Y223-C293 HydrophobicContact CE2-CB 4.37Å; Y223-S304 WeakPolarHBondContact CD2-O 3.37Å; Y223-S304 WeakPolarHBondContact CD2-OG 3.35Å; Y223-S304 WeakPolarHBondContact CE2-O 3.46Å; Y223-S304 VanDerWaalsContact CG-OG 3.28Å; Y223-S304 PolarHBondContact N-OG 3.17Å; Y223-A305 WeakPolarHBondContact CB-O 3.2Å; Y223-V306 HydrophobicContact CD2-CB 3.67Å; Y223-V306 HydrophobicContact CD2-CG1 3.83Å; Y223-V306 HydrophobicContact CE2-CB 4.45Å; Y223-V306 HydrophobicContact CE2-CG1 4.12Å; Y223-V306 HydrophobicContact CG-CB 3.73Å; Y223-V306 HydrophobicContact CG-CG1 4.21Å
224	H	87.5	Confident	93.4	Very high	173 Å²	173	57 Å²	57	80%	0.801	30%	0.298	S	S	*	.			trans	-124.6	118.1	174.7	-61.4	-62.9	0	0	0	109.6	K222	K222-H224 PolarHBondContact O-CD2 3.34Å; K222-H224 PolarHBondContact O-NE2 3.17Å
225	G	90.4	Very high	93.5	Very high	60 Å²	60	55 Å²	55	62%	0.619	29%	0.291	S	S	*	.	S	Bend	trans	75.9	-132.6	172.7	0	0	0	0	0	114.9	L307	G225-L307 PolarHBondContact O-N 3.17Å
226	S	95.1	Very high	93.6	Very high	39 Å²	39	59.8 Å²	59.8	27%	0.273	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	139.6	-172.7	66.6	0	0	0	0	112.5	L307 R309	S226-L307 CarbonylContact C-O 3.5Å; S226-L307 WeakPolarHBondContact CA-O 3.48Å; S226-L307 VanDerWaalsContact CB-O 3.32Å; S226-L307 WeakPolarHBondContact CB-O 3.31Å; S226-R309 PolarHBondContact OG-NH1 2.76Å
227	K	95	Very high	93.7	Very high	76 Å²	76	57.1 Å²	57.1	33%	0.33	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	130.9	166.3	-73.2	-177	172.3	-177.3	0	109.5	F229 E236 V306 L307 R309	K227-F229 HydrophobicContact CB-CD2 4.42Å; K227-F229 HydrophobicContact CB-CE2 3.66Å; K227-F229 HydrophobicContact CB-CZ 4.35Å; K227-F229 HydrophobicContact CD-CE2 4.42Å; K227-F229 HydrophobicContact CD-CZ 4.49Å; K227-E236 PolarHBondContact NZ-O 2.94Å; K227-V306 HydrophobicContact CB-CG2 4.38Å; K227-V306 HydrophobicContact CD-CG2 4.31Å; K227-V306 HydrophobicContact CG-CG2 3.95Å; K227-L307 PolarHBondContact N-O 2.88Å; K227-R309 PolarHBondContact O-N 3.11Å
228	N	94.4	Very high	93.6	Very high	79 Å²	79	59.2 Å²	59.2	42%	0.422	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	130.4	-177.5	-61.3	-89.4	0	0	0	109.9	R309	N228-R309 CarbonylContact C-O 3.47Å; N228-R309 WeakPolarHBondContact CA-O 3.42Å; N228-R309 WeakPolarHBondContact OD1-CB 3.31Å; N228-R309 WeakPolarHBondContact OD1-CD 3.48Å
229	F	95.2	Very high	93.6	Very high	42 Å²	42	58.9 Å²	58.9	18%	0.184	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	162.8	177.9	-64.4	-85.7	0	0	0	109.8	K227 D233 A235 L283 L308 R309 V310 K311	K227-F229 HydrophobicContact CB-CD2 4.42Å; K227-F229 HydrophobicContact CB-CE2 3.66Å; K227-F229 HydrophobicContact CB-CZ 4.35Å; K227-F229 HydrophobicContact CD-CE2 4.42Å; K227-F229 HydrophobicContact CD-CZ 4.49Å; F229-D233 HydrophobicContact CB-CB 4.29Å; F229-D233 HydrophobicContact CD1-CB 4.36Å; F229-A235 HydrophobicContact CD1-CB 4.19Å; F229-A235 HydrophobicContact CD2-CB 4Å; F229-A235 HydrophobicContact CE1-CB 3.77Å; F229-A235 HydrophobicContact CE2-CB 3.55Å; F229-A235 HydrophobicContact CG-CB 4.3Å; F229-A235 HydrophobicContact CZ-CB 3.44Å; F229-A235 VanDerWaalsContact CZ-CB 3.44Å; F229-L283 HydrophobicContact CB-CD1 3.37Å; F229-L283 HydrophobicContact CD1-CD1 4.07Å; F229-L283 HydrophobicContact CD2-CD1 4.05Å; F229-L283 HydrophobicContact CG-CD1 3.58Å; F229-L308 HydrophobicContact CD2-CD1 4.44Å; F229-L308 HydrophobicContact CD2-CG 4.18Å; F229-L308 HydrophobicContact CE2-CD1 4.35Å; F229-L308 HydrophobicContact CE2-CG 4.39Å; F229-R309 PolarHBondContact N-O 2.88Å; F229-V310 CarbonylContact O-C 3.58Å; F229-V310 WeakPolarHBondContact O-CA 3.41Å; F229-K311 PolarHBondContact O-N 2.66Å
230	M	94.1	Very high	93.5	Very high	71 Å²	71	60.8 Å²	60.8	35%	0.35	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	154.1	167.1	-57.2	-69.7	-86.3	0	0	109.3	G232 D233 K311 K313	M230-G232 PolarHBondContact O-N 2.88Å; M230-D233 WeakPolarHBondContact CA-OD2 3.13Å; M230-D233 WeakPolarHBondContact CB-OD2 3.34Å; M230-D233 PolarHBondContact N-OD2 2.81Å; M230-D233 VanDerWaalsContact O-CB 3.24Å; M230-D233 WeakPolarHBondContact O-CB 3.32Å; M230-D233 PolarHBondContact O-N 2.95Å; M230-D233 VanDerWaalsContact O-N 3.09Å; M230-K311 CarbonylContact C-O 3.57Å; M230-K311 WeakPolarHBondContact CA-O 3.18Å; M230-K311 HydrophobicContact SD-CB 3.84Å; M230-K313 HydrophobicContact CB-CG 4.38Å; M230-K313 HydrophobicContact CE-CB 4.48Å; M230-K313 HydrophobicContact CE-CG 4.5Å
231	E	95.3	Very high	93.7	Very high	67 Å²	67	58 Å²	58	31%	0.313	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.9	141	170	-174.8	178	-146.7	0	0	109.7	D233 L283 F285 V310 K311 K313	E231-D233 PolarHBondContact O-N 3.06Å; E231-L283 CarbonylContact C-O 3.56Å; E231-L283 WeakPolarHBondContact CA-O 3.47Å; E231-L283 WeakPolarHBondContact CG-O 3Å; E231-F285 HydrophobicContact CB-CZ 4.42Å; E231-F285 WeakPolarHBondContact OE1-CE2 3.48Å; E231-V310 HydrophobicContact CB-CG1 4.06Å; E231-K311 PolarHBondContact N-O 3.43Å; E231-K313 WeakPolarHBondContact O-CE 3.32Å; E231-K313 PolarHBondContact O-NZ 3.01Å
232	G	94.4	Very high	93.7	Very high	25 Å²	25	55.3 Å²	55.3	26%	0.258	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	70.8	-0.9	-176.8	0	0	0	0	0	115.9	M230 L283	M230-G232 PolarHBondContact O-N 2.88Å; G232-L283 PolarHBondContact N-O 2.87Å
233	D	95.9	Very high	93.6	Very high	62 Å²	62	52.2 Å²	52.2	33%	0.332	28%	0.277	S	S	.	.			trans	-69.9	168.9	165.8	-70.1	-12.3	0	0	0	110.3	F229 M230 E231 D282 L283	F229-D233 HydrophobicContact CB-CB 4.29Å; F229-D233 HydrophobicContact CD1-CB 4.36Å; M230-D233 WeakPolarHBondContact CA-OD2 3.13Å; M230-D233 WeakPolarHBondContact CB-OD2 3.34Å; M230-D233 PolarHBondContact N-OD2 2.81Å; M230-D233 VanDerWaalsContact O-CB 3.24Å; M230-D233 WeakPolarHBondContact O-CB 3.32Å; M230-D233 PolarHBondContact O-N 2.95Å; M230-D233 VanDerWaalsContact O-N 3.09Å; E231-D233 PolarHBondContact O-N 3.06Å; D233-D282 PolarHBondContact O-N 3.45Å; D233-L283 HydrophobicContact CB-CD1 4.27Å; D233-L283 WeakPolarHBondContact O-CB 3.37Å; D233-L283 VanDerWaalsContact O-CG 3.24Å; D233-L283 WeakPolarHBondContact O-CG 3.26Å; D233-L283 PolarHBondContact O-N 3.34Å
234	N	95.3	Very high	93.5	Very high	102 Å²	102	50.6 Å²	50.6	55%	0.545	27%	0.271	S	S	.	.			trans	-107.5	137.9	168.5	-59.4	-25.4	0	0	0	109.3	L280 K281 D282	N234-L280 CarbonylContact C-O 3.54Å; N234-L280 VanDerWaalsContact CA-O 3.3Å; N234-L280 WeakPolarHBondContact CA-O 3.38Å; N234-K281 VanDerWaalsContact OD1-CA 3.26Å; N234-K281 WeakPolarHBondContact OD1-CA 3.36Å; N234-D282 PolarHBondContact OD1-N 3.47Å
235	A	95.2	Very high	93.6	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	142.2	174.5	0	0	0	0	0	111.9	F229 V279 L280 L283 L308	F229-A235 HydrophobicContact CD1-CB 4.19Å; F229-A235 HydrophobicContact CD2-CB 4Å; F229-A235 HydrophobicContact CE1-CB 3.77Å; F229-A235 HydrophobicContact CE2-CB 3.55Å; F229-A235 HydrophobicContact CG-CB 4.3Å; F229-A235 HydrophobicContact CZ-CB 3.44Å; F229-A235 VanDerWaalsContact CZ-CB 3.44Å; A235-V279 WeakPolarHBondContact O-CA 3.45Å; A235-L280 HydrophobicContact CB-CB 4.48Å; A235-L280 HydrophobicContact CB-CD1 4.41Å; A235-L280 PolarHBondContact N-O 2.88Å; A235-L280 PolarHBondContact O-N 2.87Å; A235-L283 HydrophobicContact CB-CD1 3.86Å; A235-L283 HydrophobicContact CB-CD2 4.28Å; A235-L283 HydrophobicContact CB-CG 4.45Å; A235-L308 HydrophobicContact CB-CD1 3.93Å
236	E	94.2	Very high	93.3	Very high	103 Å²	103	41 Å²	41	48%	0.481	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	130	168.3	-64.9	-177.2	-176.9	0	0	110	K227 I277 L278 V279	K227-E236 PolarHBondContact NZ-O 2.94Å; E236-I277 HydrophobicContact CB-CG2 4.3Å; E236-L278 WeakPolarHBondContact CA-O 3.45Å; E236-V279 HydrophobicContact CG-CG1 4.49Å; E236-V279 HydrophobicContact CG-CG2 4.31Å
237	I	94.8	Very high	93.1	Very high	1 Å²	1	39.1 Å²	39.1	1%	0.005	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	101.8	177.6	-50.1	176	0	0	0	107.9	Y223 W251 I277 L278 L280 Y291 V306 L308	Y223-I237 HydrophobicContact CE1-CG2 4.16Å; Y223-I237 HydrophobicContact CE2-CG2 4.03Å; Y223-I237 WeakPolarHBondContact OH-CG2 3.49Å; I237-W251 HydrophobicContact CB-CH2 4.03Å; I237-W251 HydrophobicContact CB-CZ3 4.26Å; I237-W251 HydrophobicContact CG2-CH2 3.68Å; I237-W251 HydrophobicContact CG2-CZ3 3.79Å; I237-W251 VanDerWaalsContact O-CH2 3.26Å; I237-W251 WeakPolarHBondContact O-CH2 3.22Å; I237-W251 WeakPolarHBondContact O-CZ2 3.3Å; I237-I277 WeakPolarHBondContact O-CA 3.47Å; I237-L278 HydrophobicContact CB-CB 4.35Å; I237-L278 HydrophobicContact CD1-CD2 4.4Å; I237-L278 PolarHBondContact N-O 2.83Å; I237-L278 PolarHBondContact O-N 2.99Å; I237-L280 HydrophobicContact CD1-CD1 4.19Å; I237-Y291 HydrophobicContact CD1-CD1 4.42Å; I237-Y291 HydrophobicContact CD1-CD2 4.05Å; I237-Y291 HydrophobicContact CD1-CG 3.81Å; I237-V306 HydrophobicContact CD1-CG1 4.08Å; I237-V306 HydrophobicContact CG2-CG1 3.76Å; I237-L308 HydrophobicContact CD1-CD1 4.13Å
238	N	93.8	Very high	92.8	Very high	45 Å²	45	42.7 Å²	42.7	24%	0.241	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	129.8	-178.6	-58.6	-31.5	0	0	0	111	Y223 I277	Y223-N238 WeakPolarHBondContact CE1-O 3.33Å; Y223-N238 VanDerWaalsContact CZ-O 3.29Å; Y223-N238 PolarHBondContact OH-O 3.05Å; N238-I277 HydrophobicContact CB-CG1 4.43Å; N238-I277 VanDerWaalsContact OD1-CG1 3.3Å; N238-I277 WeakPolarHBondContact OD1-CG1 3.37Å; N238-I277 WeakPolarHBondContact OD1-CG2 3.17Å
239	C	94.3	Very high	92.7	Very high	2 Å²	2	39.3 Å²	39.3	1%	0.014	20%	0.196	C	C	.	.			trans	-104.1	95.4	174.1	-166.4	0	0	0	0	110	Y223 V241 W251 A276 C293	Y223-C239 WeakPolarHBondContact OH-CA 3.32Å; Y223-C239 PolarHBondContact OH-N 2.86Å; C239-V241 VanDerWaalsContact C-N 3.28Å; C239-V241 PolarHBondContact O-N 2.85Å; C239-W251 HydrophobicContact CB-CH2 4.13Å; C239-W251 HydrophobicContact CB-CZ2 4.02Å; C239-A276 VanDerWaalsContact CB-O 3.29Å; C239-A276 WeakPolarHBondContact CB-O 3.46Å; C239-A276 PolarHBondContact N-O 2.79Å; C239-C293 HydrophobicContact CB-CB 3.73Å; C239-C293 WeakPolarHBondContact CB-SG 3.41Å; C239-C293 WeakPolarHBondContact SG-CB 3.45Å; C239-C293 CovalentContact SG-SG 2.02Å; C239-C293 PolarHBondContact SG-SG 3.38Å
240	H	92.5	Very high	92.7	Very high	44 Å²	44	40.6 Å²	40.6	20%	0.204	20%	0.204	C	C	.	.			trans	-77.3	78	-177.6	-62.1	-56.5	0	0	0	111.4	L220 E221	L220-H240 PolarHBondContact N-O 3.45Å; E221-H240 HydrophobicContact CB-CB 4.13Å; E221-H240 HydrophobicContact CG-CB 4.41Å; E221-H240 IonicContact OE2-CD2 2.75Å; E221-H240 PolarHBondContact OE2-CD2 2.88Å; E221-H240 IonicContact OE2-CG 2.76Å; E221-H240 IonicContact OE2-NE2 2.77Å
241	V	93	Very high	92.7	Very high	14 Å²	14	37.5 Å²	37.5	9%	0.085	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	142.1	-177.5	70.2	0	0	0	0	112.1	T218 C239 P247 I249 V273 A295	T218-V241 WeakPolarHBondContact O-CA 3.34Å; C239-V241 VanDerWaalsContact C-N 3.28Å; C239-V241 PolarHBondContact O-N 2.85Å; V241-P247 HydrophobicContact CG1-CB 4.45Å; V241-P247 HydrophobicContact CG2-CB 3.84Å; V241-P247 HydrophobicContact CG2-CG 3.8Å; V241-I249 HydrophobicContact CB-CD1 4.22Å; V241-I249 HydrophobicContact CG1-CD1 3.9Å; V241-I249 HydrophobicContact CG2-CD1 4.41Å; V241-V273 HydrophobicContact CG1-CB 4.17Å; V241-V273 HydrophobicContact CG1-CG1 3.57Å; V241-V273 HydrophobicContact CG1-CG2 3.8Å; V241-A295 HydrophobicContact CB-CB 4.22Å; V241-A295 HydrophobicContact CG2-CB 3.38Å
242	Y	91.7	Very high	92.7	Very high	56 Å²	56	36.7 Å²	36.7	22%	0.22	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	166.3	169.1	-64	-94.2	0	0	0	110	K193 A217 T218 L220	K193-Y242 HydrophobicContact CB-CD1 4.26Å; K193-Y242 HydrophobicContact CB-CE1 4.25Å; K193-Y242 HydrophobicContact CG-CD1 4.18Å; K193-Y242 HydrophobicContact CG-CE1 4.04Å; K193-Y242 HydrophobicContact CG-CG 4.47Å; A217-Y242 CarbonylContact C-O 3.58Å; A217-Y242 WeakPolarHBondContact CA-O 3.19Å; T218-Y242 PolarHBondContact N-O 3.22Å; T218-Y242 PolarHBondContact O-N 2.84Å; L220-Y242 HydrophobicContact CB-CD2 4.44Å; L220-Y242 HydrophobicContact CB-CE2 4.47Å; L220-Y242 HydrophobicContact CD1-CD2 3.61Å; L220-Y242 HydrophobicContact CD1-CE2 3.75Å; L220-Y242 HydrophobicContact CD1-CG 4.33Å; L220-Y242 HydrophobicContact CG-CD2 3.91Å; L220-Y242 HydrophobicContact CG-CE2 4.29Å
243	G	90.7	Very high	92.8	Very high	2 Å²	2	38.1 Å²	38.1	2%	0.021	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	134.9	158.3	-179.8	0	0	0	0	0	112	R33	R33-G243 PolarHBondContact NH2-O 3.47Å
244	H	90.4	Very high	92.7	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146	127.1	175.5	-177	66.1	0	0	0	109.3	D30 C195 Q212 V213 R214 G215 I299	D30-H244 PolarHBondContact O-CE1 2.93Å; C195-H244 HydrophobicContact CB-CB 4.01Å; Q212-H244 PolarHBondContact OE1-NE2 2.82Å; V213-H244 VanDerWaalsContact O-CB 3.29Å; V213-H244 WeakPolarHBondContact O-CB 3.14Å; R214-H244 CarbonylContact C-O 3.59Å; R214-H244 VanDerWaalsContact CA-O 3.24Å; R214-H244 WeakPolarHBondContact CA-O 3.36Å; R214-H244 WeakPolarHBondContact CB-O 3.1Å; G215-H244 PolarHBondContact N-O 3.11Å; G215-H244 PolarHBondContact O-N 2.71Å; G215-H244 VanDerWaalsContact O-N 3.09Å; G215-H244 VanDerWaalsContact O-O 3.05Å; H244-I299 VanDerWaalsContact O-CD1 3.31Å; H244-I299 WeakPolarHBondContact O-CD1 3.02Å
245	P	89.4	Confident	92.6	Very high	5 Å²	5	40.4 Å²	40.4	3%	0.032	20%	0.196	C	C	.	.	S	Bend	cis	-58.3	158.8	6.4	-31	40.3	0	0	0	116.4	D30 P247 N297 E298	D30-P245 HydrophobicContact CB-CB 4.3Å; D30-P245 WeakPolarHBondContact OD1-CB 3.33Å; P245-P247 WeakPolarHBondContact O-CD 3.35Å; P245-N297 WeakPolarHBondContact O-CB 3.36Å; P245-N297 PolarHBondContact O-ND2 3.04Å; P245-E298 HydrophobicContact CG-CG 3.81Å; P245-E298 WeakPolarHBondContact CG-OE1 3Å
246	L	85.7	Confident	92.5	Very high	25 Å²	25	46.2 Å²	46.2	13%	0.131	23%	0.227	C	C	.	.	P	Polyproline II helix	trans	-54	119.2	-175.2	178.8	70.3	0	0	0	110.2	G272 V273	L246-G272 WeakPolarHBondContact CD2-O 3.09Å; L246-V273 HydrophobicContact CD1-CB 4.39Å; L246-V273 HydrophobicContact CD1-CG2 3.71Å
247	P	90.2	Very high	92.5	Very high	1 Å²	1	45.8 Å²	45.8	1%	0.006	23%	0.228	C	C	.	.	P	Polyproline II helix	trans	-65.8	145.1	-177.5	-24.8	36.3	0	0	0	112.8	A217 V241 P245 V296	A217-P247 HydrophobicContact CB-CB 3.89Å; A217-P247 HydrophobicContact CB-CG 3.86Å; V241-P247 HydrophobicContact CG1-CB 4.45Å; V241-P247 HydrophobicContact CG2-CB 3.84Å; V241-P247 HydrophobicContact CG2-CG 3.8Å; P245-P247 WeakPolarHBondContact O-CD 3.35Å; P247-V296 CarbonylContact C-O 3.57Å; P247-V296 WeakPolarHBondContact CA-O 3.18Å
248	K	89	Confident	92.2	Very high	150 Å²	150	47 Å²	47	65%	0.652	23%	0.234	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-93.9	137.6	166.3	-65.3	176.8	-176.2	172.5	0	108.9	V296	K248-V296 HydrophobicContact CB-CG1 4.19Å; K248-V296 PolarHBondContact N-O 3.01Å; K248-V296 PolarHBondContact O-N 3.14Å
249	I	92.1	Very high	91.5	Very high	9 Å²	9	50.1 Å²	50.1	5%	0.046	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	130	177.4	-59.1	-53.8	0	0	0	110.8	V241 W251 V273 N275 C293 I294 A295	V241-I249 HydrophobicContact CB-CD1 4.22Å; V241-I249 HydrophobicContact CG1-CD1 3.9Å; V241-I249 HydrophobicContact CG2-CD1 4.41Å; I249-W251 HydrophobicContact CG2-CZ2 4.45Å; I249-V273 HydrophobicContact CD1-CG1 4.29Å; I249-V273 HydrophobicContact CG1-CG1 3.7Å; I249-N275 HydrophobicContact CB-CB 4.23Å; I249-N275 WeakPolarHBondContact CG2-O 3.32Å; I249-C293 VanDerWaalsContact CG2-SG 3.52Å; I249-I294 WeakPolarHBondContact CA-O 3.4Å; I249-A295 HydrophobicContact CD1-CB 3.61Å
250	I	93.9	Very high	90.6	Very high	69 Å²	69	54.9 Å²	54.9	35%	0.354	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	125.4	171.8	-57.7	165.8	0	0	0	107.5	I294 V296	I250-I294 HydrophobicContact CB-CB 4.3Å; I250-I294 PolarHBondContact N-O 3.38Å; I250-I294 PolarHBondContact O-N 2.83Å; I250-V296 HydrophobicContact CD1-CG1 4.31Å
251	W	95.4	Very high	90.1	Very high	6 Å²	6	55.3 Å²	55.3	2%	0.023	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	136.2	173.7	-72.2	100.1	0	0	0	110.3	I237 C239 I249 L258 N275 L278 T292 C293	I237-W251 HydrophobicContact CB-CH2 4.03Å; I237-W251 HydrophobicContact CB-CZ3 4.26Å; I237-W251 HydrophobicContact CG2-CH2 3.68Å; I237-W251 HydrophobicContact CG2-CZ3 3.79Å; I237-W251 VanDerWaalsContact O-CH2 3.26Å; I237-W251 WeakPolarHBondContact O-CH2 3.22Å; I237-W251 WeakPolarHBondContact O-CZ2 3.3Å; C239-W251 HydrophobicContact CB-CH2 4.13Å; C239-W251 HydrophobicContact CB-CZ2 4.02Å; I249-W251 HydrophobicContact CG2-CZ2 4.45Å; W251-L258 HydrophobicContact CB-CB 4.08Å; W251-L258 HydrophobicContact CB-CD2 4.26Å; W251-L258 WeakPolarHBondContact O-CB 3.44Å; W251-L258 PolarHBondContact O-N 2.81Å; W251-N275 PolarHBondContact NE1-O 3.46Å; W251-L278 HydrophobicContact CD2-CB 3.77Å; W251-L278 HydrophobicContact CD2-CD2 3.94Å; W251-L278 HydrophobicContact CD2-CG 4.35Å; W251-L278 HydrophobicContact CE3-CB 4.07Å; W251-L278 HydrophobicContact CE3-CD2 3.79Å; W251-L278 HydrophobicContact CG-CB 4.36Å; W251-L278 HydrophobicContact CG-CD1 4.5Å; W251-L278 HydrophobicContact CG-CD2 4.29Å; W251-L278 HydrophobicContact CH2-CB 3.96Å; W251-L278 HydrophobicContact CZ2-CB 3.65Å; W251-L278 HydrophobicContact CZ3-CB 4.15Å; W251-L278 HydrophobicContact CZ3-CD2 4.29Å; W251-T292 CarbonylContact C-O 3.46Å; W251-T292 WeakPolarHBondContact CA-O 3.45Å; W251-C293 HydrophobicContact CE3-CB 4.11Å; W251-C293 HydrophobicContact CH2-CB 3.74Å; W251-C293 HydrophobicContact CZ2-CB 4.22Å; W251-C293 HydrophobicContact CZ3-CB 3.67Å
252	K	96	Very high	89.6	Confident	49 Å²	49	58.6 Å²	58.6	21%	0.213	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	140.5	167.5	-55.9	-171.6	73.3	-169.4	0	110.4	D255 N256 Y291 T292 I294	K252-D255 VanDerWaalsContact CE-C 3.49Å; K252-D255 WeakPolarHBondContact CE-O 3.03Å; K252-D255 PolarHBondContact NZ-O 2.9Å; K252-N256 CarbonylContact C-O 3.53Å; K252-N256 WeakPolarHBondContact CA-O 3.5Å; K252-N256 WeakPolarHBondContact CB-O 3.37Å; K252-Y291 WeakPolarHBondContact O-CA 3.39Å; K252-T292 PolarHBondContact N-O 3.28Å; K252-T292 PolarHBondContact O-N 2.99Å; K252-I294 HydrophobicContact CD-CD1 3.52Å; K252-I294 HydrophobicContact CG-CD1 3.93Å
253	Q	95.2	Very high	89.1	Confident	55 Å²	55	61.5 Å²	61.5	26%	0.257	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	112.5	165.9	-175.7	-176.8	11.4	0	0	106.9	D255 N256 L258 A289 Y291	Q253-D255 PolarHBondContact O-N 3.42Å; Q253-N256 PolarHBondContact N-O 2.63Å; Q253-N256 PolarHBondContact O-N 3.38Å; Q253-N256 VanDerWaalsContact O-N 3.11Å; Q253-L258 HydrophobicContact CB-CD1 4.24Å; Q253-A289 HydrophobicContact CG-CB 3.44Å; Q253-A289 VanDerWaalsContact CG-CB 3.44Å; Q253-Y291 HydrophobicContact CB-CE1 4.21Å; Q253-Y291 HydrophobicContact CG-CE1 4.03Å; Q253-Y291 PolarHBondContact NE2-OH 3.02Å
254	D	94.3	Very high	89	Confident	76 Å²	76	63.8 Å²	63.8	41%	0.406	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.1	-121.5	-164.1	-55.6	-47.3	0	0	0	110	L290	D254-L290 WeakPolarHBondContact CA-O 3.14Å; D254-L290 PolarHBondContact N-O 3.2Å; D254-L290 PolarHBondContact OD1-N 2.98Å
255	D	92.4	Very high	89	Confident	136 Å²	136	64.4 Å²	64.4	73%	0.727	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90	-7.1	-178	-66.2	-47.1	0	0	0	114.2	K252 Q253	K252-D255 VanDerWaalsContact CE-C 3.49Å; K252-D255 WeakPolarHBondContact CE-O 3.03Å; K252-D255 PolarHBondContact NZ-O 2.9Å; Q253-D255 PolarHBondContact O-N 3.42Å
256	N	94.4	Very high	88.9	Confident	122 Å²	122	65.1 Å²	65.1	65%	0.652	34%	0.336	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101.6	141.8	-173.2	-65	-53	0	0	0	112.1	K252 Q253 L258	K252-N256 CarbonylContact C-O 3.53Å; K252-N256 WeakPolarHBondContact CA-O 3.5Å; K252-N256 WeakPolarHBondContact CB-O 3.37Å; Q253-N256 PolarHBondContact N-O 2.63Å; Q253-N256 PolarHBondContact O-N 3.38Å; Q253-N256 VanDerWaalsContact O-N 3.11Å; N256-L258 PolarHBondContact O-N 3.41Å
257	N	92.6	Very high	88.9	Confident	95 Å²	95	64 Å²	64	51%	0.508	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.2	130.3	172	-70.6	-8.4	0	0	0	109.8	T259	N257-T259 HydrophobicContact CB-CG2 4.17Å; N257-T259 PolarHBondContact O-N 2.97Å; N257-T259 VanDerWaalsContact O-N 3.1Å
258	L	89.3	Confident	88.5	Confident	25 Å²	25	66.4 Å²	66.4	13%	0.131	34%	0.342	C	S	.	.			trans	-78.9	94.5	174.7	-168.5	71.2	0	0	0	108.5	W251 Q253 N256 F261 V265 L278	W251-L258 HydrophobicContact CB-CB 4.08Å; W251-L258 HydrophobicContact CB-CD2 4.26Å; W251-L258 WeakPolarHBondContact O-CB 3.44Å; W251-L258 PolarHBondContact O-N 2.81Å; Q253-L258 HydrophobicContact CB-CD1 4.24Å; N256-L258 PolarHBondContact O-N 3.41Å; L258-F261 HydrophobicContact CD2-CE1 4.07Å; L258-F261 HydrophobicContact CG-CE1 4.35Å; L258-V265 HydrophobicContact CD2-CG1 3.93Å; L258-L278 HydrophobicContact CD2-CD1 3.65Å; L258-L278 HydrophobicContact CD2-CD2 4.02Å
259	T	79.1	Confident	87.9	Confident	111 Å²	111	60.3 Å²	60.3	68%	0.681	32%	0.32	S	S	*	.			trans	-101.1	-17.1	-178.2	55.5	0	0	0	0	113.6	N257	N257-T259 HydrophobicContact CB-CG2 4.17Å; N257-T259 PolarHBondContact O-N 2.97Å; N257-T259 VanDerWaalsContact O-N 3.1Å
260	T	75.3	Confident	87.3	Confident	102 Å²	102	62.1 Å²	62.1	63%	0.626	33%	0.33	S	S	*	.			trans	-97.2	110.8	-175.7	-52.2	0	0	0	0	109
261	F	83	Confident	86.4	Confident	53 Å²	53	64.9 Å²	64.9	23%	0.232	34%	0.339	C	S	.	.			trans	-111.9	137	173.2	-60.7	-64.4	0	0	0	110.3	L258 V265 A267 L278	L258-F261 HydrophobicContact CD2-CE1 4.07Å; L258-F261 HydrophobicContact CG-CE1 4.35Å; F261-V265 CarbonylContact C-O 3.59Å; F261-V265 WeakPolarHBondContact CA-O 3.24Å; F261-A267 HydrophobicContact CE1-CB 4.08Å; F261-A267 HydrophobicContact CZ-CB 4.24Å; F261-L278 HydrophobicContact CE1-CD1 4.31Å
262	D	81.5	Confident	85.2	Confident	83 Å²	83	65.6 Å²	65.6	44%	0.444	35%	0.349	S	S	.	.			trans	-142.1	-169.2	178.2	69.3	18.3	0	0	0	111	R264 V265	D262-R264 PolarHBondContact O-N 2.89Å; D262-R264 VanDerWaalsContact O-N 3.16Å; D262-R264 VanDerWaalsContact OD1-CA 3.3Å; D262-R264 WeakPolarHBondContact OD1-CA 3.25Å; D262-R264 VanDerWaalsContact OD1-CB 3.26Å; D262-R264 WeakPolarHBondContact OD1-CB 3.27Å; D262-R264 PolarHBondContact OD1-N 3.33Å; D262-V265 PolarHBondContact N-O 3.08Å; D262-V265 CarbonylContact O-C 3.55Å; D262-V265 PolarHBondContact OD1-N 2.86Å
263	N	80.9	Confident	84.5	Confident	118 Å²	118	63.6 Å²	63.6	63%	0.631	34%	0.341	S	S	*	.	S	Bend	trans	-65.7	-15.6	-179.8	-69.9	-22.7	0	0	0	113.9
264	R	89.4	Confident	83.6	Confident	50 Å²	50	62.1 Å²	62.1	19%	0.189	34%	0.336	C	S	.	.	S	Bend	trans	-99.9	-46.6	-177.9	-167.2	-174.1	70	84.1	-4.9	111.3	D262 L280 K281 D287	D262-R264 PolarHBondContact O-N 2.89Å; D262-R264 VanDerWaalsContact O-N 3.16Å; D262-R264 VanDerWaalsContact OD1-CA 3.3Å; D262-R264 WeakPolarHBondContact OD1-CA 3.25Å; D262-R264 VanDerWaalsContact OD1-CB 3.26Å; D262-R264 WeakPolarHBondContact OD1-CB 3.27Å; D262-R264 PolarHBondContact OD1-N 3.33Å; R264-L280 CarbonylContact O-C 3.52Å; R264-L280 WeakPolarHBondContact O-CA 3.42Å; R264-K281 WeakPolarHBondContact CD-O 3.36Å; R264-K281 HydrophobicContact CG-CB 4.28Å; R264-K281 WeakPolarHBondContact CG-O 3.28Å; R264-K281 PolarHBondContact NH1-O 2.8Å; R264-K281 PolarHBondContact O-N 2.88Å; R264-D287 IonicContact CZ-OD1 2.74Å; R264-D287 VanDerWaalsContact CZ-OD1 3.28Å; R264-D287 IonicContact CZ-OD2 2.87Å; R264-D287 IonicContact NH1-OD1 3.65Å; R264-D287 PolarHBondContact NH1-OD1 2.85Å; R264-D287 IonicContact NH1-OD2 3.58Å; R264-D287 PolarHBondContact NH1-OD2 2.89Å; R264-D287 IonicContact NH2-OD1 3.75Å; R264-D287 PolarHBondContact NH2-OD1 3.33Å; R264-D287 IonicContact NH2-OD2 3.34Å
265	V	89.9	Confident	83.2	Confident	12 Å²	12	60.2 Å²	60.2	7%	0.073	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	111	179.6	-176.7	0	0	0	0	109	L258 F261 D262 L278 V279 L280	L258-V265 HydrophobicContact CD2-CG1 3.93Å; F261-V265 CarbonylContact C-O 3.59Å; F261-V265 WeakPolarHBondContact CA-O 3.24Å; D262-V265 PolarHBondContact N-O 3.08Å; D262-V265 CarbonylContact O-C 3.55Å; D262-V265 PolarHBondContact OD1-N 2.86Å; V265-L278 HydrophobicContact CG1-CD1 4.14Å; V265-V279 WeakPolarHBondContact CA-O 3.48Å; V265-L280 HydrophobicContact CG2-CD2 4.33Å; V265-L280 HydrophobicContact CG2-CG 4.42Å
266	Y	87.5	Confident	83	Confident	20 Å²	20	53.8 Å²	53.8	8%	0.078	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	161	179.2	61.9	-85	0	0	0	110.9	V279 K281	Y266-V279 HydrophobicContact CD1-CB 4.36Å; Y266-V279 HydrophobicContact CD2-CB 4.27Å; Y266-V279 HydrophobicContact CD2-CG2 4.4Å; Y266-V279 HydrophobicContact CE1-CB 4Å; Y266-V279 HydrophobicContact CE1-CG1 3.85Å; Y266-V279 HydrophobicContact CE2-CB 3.92Å; Y266-V279 HydrophobicContact CE2-CG1 4.31Å; Y266-V279 HydrophobicContact CE2-CG2 3.87Å; Y266-V279 HydrophobicContact CG-CB 4.49Å; Y266-V279 PolarHBondContact N-O 3.1Å; Y266-V279 PolarHBondContact O-N 2.77Å; Y266-K281 HydrophobicContact CE1-CD 4.08Å; Y266-K281 HydrophobicContact CE1-CG 4.47Å; Y266-K281 WeakPolarHBondContact OH-CE 3.48Å; Y266-K281 PolarHBondContact OH-NZ 2.86Å
267	A	86.2	Confident	82.8	Confident	2 Å²	2	48.8 Å²	48.8	2%	0.017	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	143.1	173.1	0	0	0	0	0	110.6	F261 N275 I277	F261-A267 HydrophobicContact CE1-CB 4.08Å; F261-A267 HydrophobicContact CZ-CB 4.24Å; A267-N275 HydrophobicContact CB-CB 3.7Å; A267-I277 CarbonylContact C-O 3.52Å; A267-I277 WeakPolarHBondContact CA-O 3.32Å
268	M	80.7	Confident	82.9	Confident	51 Å²	51	44.2 Å²	44.2	25%	0.251	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	159.2	173.7	62.5	-176.7	173.1	0	0	110.3	N275 A276 I277 V279	M268-N275 CarbonylContact O-C 3.52Å; M268-N275 VanDerWaalsContact O-C 3.24Å; M268-N275 WeakPolarHBondContact O-CA 3.4Å; M268-A276 PolarHBondContact O-N 2.78Å; M268-I277 HydrophobicContact CE-CB 3.76Å; M268-I277 HydrophobicContact CE-CD1 3.67Å; M268-I277 HydrophobicContact CE-CG1 4.3Å; M268-I277 HydrophobicContact CE-CG2 3.34Å; M268-I277 HydrophobicContact CG-CB 3.63Å; M268-I277 HydrophobicContact CG-CD1 4.28Å; M268-I277 HydrophobicContact CG-CG1 4.38Å; M268-I277 HydrophobicContact CG-CG2 4.16Å; M268-I277 PolarHBondContact N-O 3Å; M268-I277 PolarHBondContact O-N 2.76Å; M268-V279 HydrophobicContact CE-CG2 3.73Å; M268-V279 HydrophobicContact CG-CG2 4.25Å; M268-V279 HydrophobicContact SD-CG2 4.07Å
269	A	77.3	Confident	83	Confident	23 Å²	23	43.2 Å²	43.2	19%	0.19	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	153.6	176.1	0	0	0	0	0	111.7	V273	A269-V273 WeakPolarHBondContact CA-O 3.36Å; A269-V273 VanDerWaalsContact CB-O 3.26Å; A269-V273 WeakPolarHBondContact CB-O 3.47Å
270	D	80	Confident	83.8	Confident	47 Å²	47	37.9 Å²	37.9	25%	0.251	20%	0.203	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	133.5	168.8	-175.1	30.6	0	0	0	109	G272 V273 A276 I277	D270-G272 PolarHBondContact O-N 2.89Å; D270-V273 PolarHBondContact N-O 3.09Å; D270-V273 VanDerWaalsContact N-O 3.11Å; D270-V273 WeakPolarHBondContact O-CB 3.33Å; D270-V273 PolarHBondContact O-N 3.33Å; D270-A276 HydrophobicContact CB-CB 3.7Å; D270-I277 HydrophobicContact CB-CD1 3.8Å; D270-I277 HydrophobicContact CB-CG1 3.93Å
271	K	74.3	Confident	84.6	Confident	126 Å²	126	36.1 Å²	36.1	55%	0.548	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	46.5	40.5	179.1	-59.4	175.3	-170.9	175.3	0	114.5	V273	K271-V273 VanDerWaalsContact C-N 3.26Å; K271-V273 PolarHBondContact O-N 3.2Å
272	G	70.8	Confident	85.1	Confident	22 Å²	22	37.4 Å²	37.4	23%	0.227	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	81.9	-10.8	-178.7	0	0	0	0	0	115.4	L246 D270 P274	L246-G272 WeakPolarHBondContact CD2-O 3.09Å; D270-G272 PolarHBondContact O-N 2.89Å; G272-P274 WeakPolarHBondContact O-CD 3.25Å
273	V	79.4	Confident	85.8	Confident	7 Å²	7	33.5 Å²	33.5	4%	0.042	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	117.2	176.8	-179.3	0	0	0	0	109.5	V241 L246 I249 A269 D270 K271 A276	V241-V273 HydrophobicContact CG1-CB 4.17Å; V241-V273 HydrophobicContact CG1-CG1 3.57Å; V241-V273 HydrophobicContact CG1-CG2 3.8Å; L246-V273 HydrophobicContact CD1-CB 4.39Å; L246-V273 HydrophobicContact CD1-CG2 3.71Å; I249-V273 HydrophobicContact CD1-CG1 4.29Å; I249-V273 HydrophobicContact CG1-CG1 3.7Å; A269-V273 WeakPolarHBondContact CA-O 3.36Å; A269-V273 VanDerWaalsContact CB-O 3.26Å; A269-V273 WeakPolarHBondContact CB-O 3.47Å; D270-V273 PolarHBondContact N-O 3.09Å; D270-V273 VanDerWaalsContact N-O 3.11Å; D270-V273 WeakPolarHBondContact O-CB 3.33Å; D270-V273 PolarHBondContact O-N 3.33Å; K271-V273 VanDerWaalsContact C-N 3.26Å; K271-V273 PolarHBondContact O-N 3.2Å; V273-A276 HydrophobicContact CB-CB 3.99Å; V273-A276 HydrophobicContact CG1-CB 3.95Å
274	P	76.9	Confident	86.5	Confident	23 Å²	23	33 Å²	33	15%	0.149	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.6	142.4	178.8	28.4	-34.1	0	0	0	111.2	G272 A276	G272-P274 WeakPolarHBondContact O-CD 3.25Å; P274-A276 PolarHBondContact O-N 3.48Å
275	N	85.7	Confident	86.7	Confident	36 Å²	36	34.1 Å²	34.1	19%	0.193	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	59.2	20.1	178.7	-52.5	-24.1	0	0	0	115.1	I249 W251 A267 M268 I277	I249-N275 HydrophobicContact CB-CB 4.23Å; I249-N275 WeakPolarHBondContact CG2-O 3.32Å; W251-N275 PolarHBondContact NE1-O 3.46Å; A267-N275 HydrophobicContact CB-CB 3.7Å; M268-N275 CarbonylContact O-C 3.52Å; M268-N275 VanDerWaalsContact O-C 3.24Å; M268-N275 WeakPolarHBondContact O-CA 3.4Å; N275-I277 PolarHBondContact O-N 2.99Å
276	A	88.6	Confident	86.9	Confident	2 Å²	2	40.5 Å²	40.5	2%	0.017	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.5	-20.4	-177.5	0	0	0	0	0	114.7	C239 M268 D270 V273 P274	C239-A276 VanDerWaalsContact CB-O 3.29Å; C239-A276 WeakPolarHBondContact CB-O 3.46Å; C239-A276 PolarHBondContact N-O 2.79Å; M268-A276 PolarHBondContact O-N 2.78Å; D270-A276 HydrophobicContact CB-CB 3.7Å; V273-A276 HydrophobicContact CB-CB 3.99Å; V273-A276 HydrophobicContact CG1-CB 3.95Å; P274-A276 PolarHBondContact O-N 3.48Å
277	I	90.2	Very high	87.2	Confident	16 Å²	16	39.8 Å²	39.8	8%	0.082	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	121.9	178.3	-52.9	172	0	0	0	109.4	E236 I237 N238 A267 M268 D270 N275 V279	E236-I277 HydrophobicContact CB-CG2 4.3Å; I237-I277 WeakPolarHBondContact O-CA 3.47Å; N238-I277 HydrophobicContact CB-CG1 4.43Å; N238-I277 VanDerWaalsContact OD1-CG1 3.3Å; N238-I277 WeakPolarHBondContact OD1-CG1 3.37Å; N238-I277 WeakPolarHBondContact OD1-CG2 3.17Å; A267-I277 CarbonylContact C-O 3.52Å; A267-I277 WeakPolarHBondContact CA-O 3.32Å; M268-I277 HydrophobicContact CE-CB 3.76Å; M268-I277 HydrophobicContact CE-CD1 3.67Å; M268-I277 HydrophobicContact CE-CG1 4.3Å; M268-I277 HydrophobicContact CE-CG2 3.34Å; M268-I277 HydrophobicContact CG-CB 3.63Å; M268-I277 HydrophobicContact CG-CD1 4.28Å; M268-I277 HydrophobicContact CG-CG1 4.38Å; M268-I277 HydrophobicContact CG-CG2 4.16Å; M268-I277 PolarHBondContact N-O 3Å; M268-I277 PolarHBondContact O-N 2.76Å; D270-I277 HydrophobicContact CB-CD1 3.8Å; D270-I277 HydrophobicContact CB-CG1 3.93Å; N275-I277 PolarHBondContact O-N 2.99Å; I277-V279 HydrophobicContact CG2-CG2 4.28Å
278	L	93.8	Very high	87.7	Confident	0 Å²	0	45.7 Å²	45.7	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	124.6	171.3	179.8	64.9	0	0	0	109.9	E236 I237 W251 L258 F261 V265 L280 Y291	E236-L278 WeakPolarHBondContact CA-O 3.45Å; I237-L278 HydrophobicContact CB-CB 4.35Å; I237-L278 HydrophobicContact CD1-CD2 4.4Å; I237-L278 PolarHBondContact N-O 2.83Å; I237-L278 PolarHBondContact O-N 2.99Å; W251-L278 HydrophobicContact CD2-CB 3.77Å; W251-L278 HydrophobicContact CD2-CD2 3.94Å; W251-L278 HydrophobicContact CD2-CG 4.35Å; W251-L278 HydrophobicContact CE3-CB 4.07Å; W251-L278 HydrophobicContact CE3-CD2 3.79Å; W251-L278 HydrophobicContact CG-CB 4.36Å; W251-L278 HydrophobicContact CG-CD1 4.5Å; W251-L278 HydrophobicContact CG-CD2 4.29Å; W251-L278 HydrophobicContact CH2-CB 3.96Å; W251-L278 HydrophobicContact CZ2-CB 3.65Å; W251-L278 HydrophobicContact CZ3-CB 4.15Å; W251-L278 HydrophobicContact CZ3-CD2 4.29Å; L258-L278 HydrophobicContact CD2-CD1 3.65Å; L258-L278 HydrophobicContact CD2-CD2 4.02Å; F261-L278 HydrophobicContact CE1-CD1 4.31Å; V265-L278 HydrophobicContact CG1-CD1 4.14Å; L278-L280 HydrophobicContact CD2-CD1 4.09Å; L278-L280 HydrophobicContact CG-CD1 3.92Å; L278-Y291 HydrophobicContact CD2-CD1 3.44Å; L278-Y291 VanDerWaalsContact CD2-CD1 3.44Å; L278-Y291 HydrophobicContact CD2-CE1 3.88Å; L278-Y291 HydrophobicContact CD2-CG 4.31Å
279	V	92.8	Very high	88.5	Confident	3 Å²	3	43.5 Å²	43.5	2%	0.018	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	128.1	179.2	-174.3	0	0	0	0	109.3	A235 E236 V265 Y266 M268 I277 K281	A235-V279 WeakPolarHBondContact O-CA 3.45Å; E236-V279 HydrophobicContact CG-CG1 4.49Å; E236-V279 HydrophobicContact CG-CG2 4.31Å; V265-V279 WeakPolarHBondContact CA-O 3.48Å; Y266-V279 HydrophobicContact CD1-CB 4.36Å; Y266-V279 HydrophobicContact CD2-CB 4.27Å; Y266-V279 HydrophobicContact CD2-CG2 4.4Å; Y266-V279 HydrophobicContact CE1-CB 4Å; Y266-V279 HydrophobicContact CE1-CG1 3.85Å; Y266-V279 HydrophobicContact CE2-CB 3.92Å; Y266-V279 HydrophobicContact CE2-CG1 4.31Å; Y266-V279 HydrophobicContact CE2-CG2 3.87Å; Y266-V279 HydrophobicContact CG-CB 4.49Å; Y266-V279 PolarHBondContact N-O 3.1Å; Y266-V279 PolarHBondContact O-N 2.77Å; M268-V279 HydrophobicContact CE-CG2 3.73Å; M268-V279 HydrophobicContact CG-CG2 4.25Å; M268-V279 HydrophobicContact SD-CG2 4.07Å; I277-V279 HydrophobicContact CG2-CG2 4.28Å; V279-K281 HydrophobicContact CG1-CG 4.21Å
280	L	94.6	Very high	89.4	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	112.1	171.7	-57.9	96.3	0	0	0	108.8	N234 A235 I237 R264 V265 L278 L283 D287 Y291 L308	N234-L280 CarbonylContact C-O 3.54Å; N234-L280 VanDerWaalsContact CA-O 3.3Å; N234-L280 WeakPolarHBondContact CA-O 3.38Å; A235-L280 HydrophobicContact CB-CB 4.48Å; A235-L280 HydrophobicContact CB-CD1 4.41Å; A235-L280 PolarHBondContact N-O 2.88Å; A235-L280 PolarHBondContact O-N 2.87Å; I237-L280 HydrophobicContact CD1-CD1 4.19Å; R264-L280 CarbonylContact O-C 3.52Å; R264-L280 WeakPolarHBondContact O-CA 3.42Å; V265-L280 HydrophobicContact CG2-CD2 4.33Å; V265-L280 HydrophobicContact CG2-CG 4.42Å; L278-L280 HydrophobicContact CD2-CD1 4.09Å; L278-L280 HydrophobicContact CG-CD1 3.92Å; L280-L283 HydrophobicContact CB-CD2 3.68Å; L280-L283 HydrophobicContact CD2-CD2 4.28Å; L280-D287 HydrophobicContact CD2-CB 4.24Å; L280-Y291 HydrophobicContact CD2-CE1 4.03Å; L280-Y291 HydrophobicContact CD2-CE2 4.48Å; L280-Y291 VanDerWaalsContact CD2-OH 3.26Å; L280-Y291 WeakPolarHBondContact CD2-OH 3.49Å; L280-L308 HydrophobicContact CD1-CD1 4.19Å
281	K	93.6	Very high	90.2	Very high	64 Å²	64	43.6 Å²	43.6	28%	0.278	21%	0.205	S	C	.	.			trans	-90.9	155.9	174.9	-64	-179.3	172.5	170.3	0	110.6	E20 N234 R264 Y266 V279 L283	E20-K281 IonicContact OE1-NZ 3.85Å; N234-K281 VanDerWaalsContact OD1-CA 3.26Å; N234-K281 WeakPolarHBondContact OD1-CA 3.36Å; R264-K281 WeakPolarHBondContact CD-O 3.36Å; R264-K281 HydrophobicContact CG-CB 4.28Å; R264-K281 WeakPolarHBondContact CG-O 3.28Å; R264-K281 PolarHBondContact NH1-O 2.8Å; R264-K281 PolarHBondContact O-N 2.88Å; Y266-K281 HydrophobicContact CE1-CD 4.08Å; Y266-K281 HydrophobicContact CE1-CG 4.47Å; Y266-K281 WeakPolarHBondContact OH-CE 3.48Å; Y266-K281 PolarHBondContact OH-NZ 2.86Å; V279-K281 HydrophobicContact CG1-CG 4.21Å; K281-L283 PolarHBondContact O-N 2.94Å
282	D	94	Very high	91.3	Very high	81 Å²	81	38.2 Å²	38.2	43%	0.433	18%	0.183	S	C	.	.	S	Bend	trans	46.4	61.3	173.7	-176.4	44.1	0	0	0	112.2	D233 N234 R284	D233-D282 PolarHBondContact O-N 3.45Å; N234-D282 PolarHBondContact OD1-N 3.47Å; D282-R284 PolarHBondContact O-N 2.84Å; D282-R284 IonicContact OD2-NE 2.98Å; D282-R284 IonicContact OD2-NH2 3.91Å
283	L	95.7	Very high	92.6	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	17%	0.172	C	C	.	.			trans	-58.1	132.9	-171.6	-77.3	171.3	0	0	0	112.7	F229 E231 G232 D233 A235 L280 K281 D287 L308 V310	F229-L283 HydrophobicContact CB-CD1 3.37Å; F229-L283 HydrophobicContact CD1-CD1 4.07Å; F229-L283 HydrophobicContact CD2-CD1 4.05Å; F229-L283 HydrophobicContact CG-CD1 3.58Å; E231-L283 CarbonylContact C-O 3.56Å; E231-L283 WeakPolarHBondContact CA-O 3.47Å; E231-L283 WeakPolarHBondContact CG-O 3Å; G232-L283 PolarHBondContact N-O 2.87Å; D233-L283 HydrophobicContact CB-CD1 4.27Å; D233-L283 WeakPolarHBondContact O-CB 3.37Å; D233-L283 VanDerWaalsContact O-CG 3.24Å; D233-L283 WeakPolarHBondContact O-CG 3.26Å; D233-L283 PolarHBondContact O-N 3.34Å; A235-L283 HydrophobicContact CB-CD1 3.86Å; A235-L283 HydrophobicContact CB-CD2 4.28Å; A235-L283 HydrophobicContact CB-CG 4.45Å; L280-L283 HydrophobicContact CB-CD2 3.68Å; L280-L283 HydrophobicContact CD2-CD2 4.28Å; K281-L283 PolarHBondContact O-N 2.94Å; L283-D287 WeakPolarHBondContact CA-OD2 3.31Å; L283-D287 HydrophobicContact CD2-CB 4.03Å; L283-L308 HydrophobicContact CD2-CD1 4.32Å; L283-L308 HydrophobicContact CD2-CD2 4.2Å; L283-V310 HydrophobicContact CB-CG1 4.28Å; L283-V310 HydrophobicContact CB-CG2 4.13Å; L283-V310 HydrophobicContact CD1-CG2 4.44Å; L283-V310 HydrophobicContact CD2-CG2 4.41Å
284	R	95	Very high	93.4	Very high	108 Å²	108	38.3 Å²	38.3	41%	0.408	18%	0.178	S	C	.	.			trans	-114.1	164.6	178.2	-58.7	179.2	-173.2	175.1	1.5	110.7	D282 E286 D287 V310	D282-R284 PolarHBondContact O-N 2.84Å; D282-R284 IonicContact OD2-NE 2.98Å; D282-R284 IonicContact OD2-NH2 3.91Å; R284-E286 WeakPolarHBondContact CD-OE2 2.93Å; R284-E286 PolarHBondContact O-N 3.39Å; R284-D287 PolarHBondContact N-OD2 2.8Å; R284-D287 WeakPolarHBondContact O-CB 3.45Å; R284-D287 PolarHBondContact O-N 3.22Å; R284-V310 WeakPolarHBondContact O-CG2 3.37Å
285	F	94.6	Very high	94.3	Very high	74 Å²	74	37.2 Å²	37.2	33%	0.325	17%	0.171	S	C	.	.	G	3₁₀ helix	trans	-62.1	-26.8	174.5	-61.8	-53.8	0	0	0	113.2	E231 D287 R288 V310 D312	E231-F285 HydrophobicContact CB-CZ 4.42Å; E231-F285 WeakPolarHBondContact OE1-CE2 3.48Å; F285-D287 PolarHBondContact O-N 3.02Å; F285-R288 WeakPolarHBondContact O-CB 3.45Å; F285-R288 WeakPolarHBondContact O-CD 3.49Å; F285-R288 VanDerWaalsContact O-CG 3.26Å; F285-R288 WeakPolarHBondContact O-CG 3.17Å; F285-R288 PolarHBondContact O-N 2.92Å; F285-V310 HydrophobicContact CD1-CB 4.4Å; F285-V310 HydrophobicContact CD1-CG1 4.21Å; F285-V310 HydrophobicContact CE1-CG1 4.35Å; F285-D312 HydrophobicContact CE1-CB 4.26Å; F285-D312 HydrophobicContact CZ-CB 3.77Å
286	E	93.2	Very high	94.7	Very high	145 Å²	145	38 Å²	38	68%	0.678	18%	0.176	S	C	*	.	G	3₁₀ helix	trans	-66.5	-22.2	174	-60.1	114.7	-153.5	0	0	113.2	R284 R288	R284-E286 WeakPolarHBondContact CD-OE2 2.93Å; R284-E286 PolarHBondContact O-N 3.39Å; E286-R288 PolarHBondContact O-N 2.88Å
287	D	94.5	Very high	95	Very high	5 Å²	5	38.7 Å²	38.7	3%	0.027	18%	0.18	C	C	.	.	G	3₁₀ helix	trans	-78.6	-6.8	179.1	-60.3	-46.3	0	0	0	112.8	R264 L280 L283 R284 F285 A289 Y291	R264-D287 IonicContact CZ-OD1 2.74Å; R264-D287 VanDerWaalsContact CZ-OD1 3.28Å; R264-D287 IonicContact CZ-OD2 2.87Å; R264-D287 IonicContact NH1-OD1 3.65Å; R264-D287 PolarHBondContact NH1-OD1 2.85Å; R264-D287 IonicContact NH1-OD2 3.58Å; R264-D287 PolarHBondContact NH1-OD2 2.89Å; R264-D287 IonicContact NH2-OD1 3.75Å; R264-D287 PolarHBondContact NH2-OD1 3.33Å; R264-D287 IonicContact NH2-OD2 3.34Å; L280-D287 HydrophobicContact CD2-CB 4.24Å; L283-D287 WeakPolarHBondContact CA-OD2 3.31Å; L283-D287 HydrophobicContact CD2-CB 4.03Å; R284-D287 PolarHBondContact N-OD2 2.8Å; R284-D287 WeakPolarHBondContact O-CB 3.45Å; R284-D287 PolarHBondContact O-N 3.22Å; F285-D287 PolarHBondContact O-N 3.02Å; D287-A289 PolarHBondContact O-N 3.09Å; D287-Y291 VanDerWaalsContact O-CE2 3.23Å; D287-Y291 WeakPolarHBondContact O-CE2 3.37Å; D287-Y291 PolarHBondContact O-OH 3.13Å
288	R	96.5	Very high	95	Very high	127 Å²	127	44.1 Å²	44.1	48%	0.479	21%	0.205	S	C	.	.			trans	-65.2	106.2	175.5	-68.7	174.9	176	171.2	2.3	109.5	F285 E286 L308 V310	F285-R288 WeakPolarHBondContact O-CB 3.45Å; F285-R288 WeakPolarHBondContact O-CD 3.49Å; F285-R288 VanDerWaalsContact O-CG 3.26Å; F285-R288 WeakPolarHBondContact O-CG 3.17Å; F285-R288 PolarHBondContact O-N 2.92Å; E286-R288 PolarHBondContact O-N 2.88Å; R288-L308 WeakPolarHBondContact CA-O 3.38Å; R288-V310 HydrophobicContact CG-CB 3.94Å; R288-V310 HydrophobicContact CG-CG2 4.03Å; R288-V310 PolarHBondContact NE-O 2.8Å; R288-V310 PolarHBondContact NH2-O 3.22Å
289	A	96.6	Very high	95	Very high	4 Å²	4	47.5 Å²	47.5	3%	0.033	22%	0.223	C	C	.	.	S	Bend	trans	-157.6	167.7	-177.9	0	0	0	0	0	111.1	Q253 D287 Y291 L308	Q253-A289 HydrophobicContact CG-CB 3.44Å; Q253-A289 VanDerWaalsContact CG-CB 3.44Å; D287-A289 PolarHBondContact O-N 3.09Å; A289-Y291 HydrophobicContact CB-CD2 4.35Å; A289-Y291 HydrophobicContact CB-CE2 3.83Å; A289-Y291 WeakPolarHBondContact O-CD2 3.21Å; A289-L308 PolarHBondContact O-N 3.38Å
290	L	97.3	Very high	95.1	Very high	71 Å²	71	48.2 Å²	48.2	37%	0.372	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	108.9	164.8	-175.7	70.3	0	0	0	108.9	D254 A305 L307	D254-L290 WeakPolarHBondContact CA-O 3.14Å; D254-L290 PolarHBondContact N-O 3.2Å; D254-L290 PolarHBondContact OD1-N 2.98Å; L290-A305 HydrophobicContact CD1-CB 3.93Å; L290-A305 HydrophobicContact CD2-CB 4.33Å; L290-A305 HydrophobicContact CG-CB 4.13Å; L290-L307 HydrophobicContact CD1-CB 4.45Å
291	Y	96.9	Very high	95.1	Very high	2 Å²	2	55.5 Å²	55.5	1%	0.008	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	123.1	175.7	-69.9	-91.2	0	0	0	109.9	I237 K252 Q253 L278 L280 D287 A289 A305 V306 L308	I237-Y291 HydrophobicContact CD1-CD1 4.42Å; I237-Y291 HydrophobicContact CD1-CD2 4.05Å; I237-Y291 HydrophobicContact CD1-CG 3.81Å; K252-Y291 WeakPolarHBondContact O-CA 3.39Å; Q253-Y291 HydrophobicContact CB-CE1 4.21Å; Q253-Y291 HydrophobicContact CG-CE1 4.03Å; Q253-Y291 PolarHBondContact NE2-OH 3.02Å; L278-Y291 HydrophobicContact CD2-CD1 3.44Å; L278-Y291 VanDerWaalsContact CD2-CD1 3.44Å; L278-Y291 HydrophobicContact CD2-CE1 3.88Å; L278-Y291 HydrophobicContact CD2-CG 4.31Å; L280-Y291 HydrophobicContact CD2-CE1 4.03Å; L280-Y291 HydrophobicContact CD2-CE2 4.48Å; L280-Y291 VanDerWaalsContact CD2-OH 3.26Å; L280-Y291 WeakPolarHBondContact CD2-OH 3.49Å; D287-Y291 VanDerWaalsContact O-CE2 3.23Å; D287-Y291 WeakPolarHBondContact O-CE2 3.37Å; D287-Y291 PolarHBondContact O-OH 3.13Å; A289-Y291 HydrophobicContact CB-CD2 4.35Å; A289-Y291 HydrophobicContact CB-CE2 3.83Å; A289-Y291 WeakPolarHBondContact O-CD2 3.21Å; Y291-A305 CarbonylContact O-C 3.53Å; Y291-A305 WeakPolarHBondContact O-CA 3.35Å; Y291-V306 PolarHBondContact N-O 3.37Å; Y291-V306 PolarHBondContact O-N 2.77Å; Y291-L308 HydrophobicContact CD2-CB 3.63Å; Y291-L308 HydrophobicContact CD2-CD1 4.29Å; Y291-L308 HydrophobicContact CE2-CB 3.64Å; Y291-L308 HydrophobicContact CE2-CD1 3.99Å; Y291-L308 HydrophobicContact CE2-CG 4.26Å
292	T	97.2	Very high	95.3	Very high	13 Å²	13	53.9 Å²	53.9	8%	0.08	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	123.2	178.9	-51.9	0	0	0	0	109.9	W251 K252 I294 E303 S304 A305	W251-T292 CarbonylContact C-O 3.46Å; W251-T292 WeakPolarHBondContact CA-O 3.45Å; K252-T292 PolarHBondContact N-O 3.28Å; K252-T292 PolarHBondContact O-N 2.99Å; T292-I294 HydrophobicContact CG2-CG1 4Å; T292-E303 HydrophobicContact CG2-CB 4.29Å; T292-S304 WeakPolarHBondContact CA-O 3.47Å; T292-A305 HydrophobicContact CG2-CB 4.17Å; T292-A305 WeakPolarHBondContact OG1-CB 3.25Å
293	C	96.6	Very high	95.4	Very high	0 Å²	0	54.5 Å²	54.5	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	123.6	165.2	176.5	0	0	0	0	108.8	Y223 C239 I249 W251 E303 S304	Y223-C293 HydrophobicContact CE2-CB 4.37Å; C239-C293 HydrophobicContact CB-CB 3.73Å; C239-C293 WeakPolarHBondContact CB-SG 3.41Å; C239-C293 WeakPolarHBondContact SG-CB 3.45Å; C239-C293 CovalentContact SG-SG 2.02Å; C239-C293 PolarHBondContact SG-SG 3.38Å; I249-C293 VanDerWaalsContact CG2-SG 3.52Å; W251-C293 HydrophobicContact CE3-CB 4.11Å; W251-C293 HydrophobicContact CH2-CB 3.74Å; W251-C293 HydrophobicContact CZ2-CB 4.22Å; W251-C293 HydrophobicContact CZ3-CB 3.67Å; C293-E303 CarbonylContact O-C 3.56Å; C293-E303 VanDerWaalsContact O-CA 3.26Å; C293-E303 WeakPolarHBondContact O-CA 3.49Å; C293-S304 PolarHBondContact N-O 2.84Å; C293-S304 PolarHBondContact O-N 2.9Å
294	I	97	Very high	95.5	Very high	31 Å²	31	54.8 Å²	54.8	16%	0.159	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	118.3	172.8	-56.3	173.3	0	0	0	107.5	I249 I250 K252 T292 W301 E303	I249-I294 WeakPolarHBondContact CA-O 3.4Å; I250-I294 HydrophobicContact CB-CB 4.3Å; I250-I294 PolarHBondContact N-O 3.38Å; I250-I294 PolarHBondContact O-N 2.83Å; K252-I294 HydrophobicContact CD-CD1 3.52Å; K252-I294 HydrophobicContact CG-CD1 3.93Å; T292-I294 HydrophobicContact CG2-CG1 4Å; I294-W301 HydrophobicContact CG2-CE3 4.47Å; I294-E303 HydrophobicContact CG1-CB 4.07Å
295	A	96	Very high	95.6	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	127.6	175.4	0	0	0	0	0	110.1	A217 I219 V241 I249 W301 D302	A217-A295 HydrophobicContact CB-CB 4.08Å; I219-A295 HydrophobicContact CD1-CB 4.21Å; I219-A295 HydrophobicContact CG1-CB 4.12Å; V241-A295 HydrophobicContact CB-CB 4.22Å; V241-A295 HydrophobicContact CG2-CB 3.38Å; I249-A295 HydrophobicContact CD1-CB 3.61Å; A295-W301 CarbonylContact O-C 3.59Å; A295-W301 WeakPolarHBondContact O-CA 3.37Å; A295-W301 VanDerWaalsContact O-CB 3.27Å; A295-W301 WeakPolarHBondContact O-CB 3.38Å; A295-D302 PolarHBondContact N-O 2Å; A295-D302 PolarHBondContact O-N 2.9Å
296	V	95	Very high	95.7	Very high	51 Å²	51	48.3 Å²	48.3	31%	0.309	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136	134.4	-178.6	60.4	0	0	0	0	111.8	P247 K248 I250 W301	P247-V296 CarbonylContact C-O 3.57Å; P247-V296 WeakPolarHBondContact CA-O 3.18Å; K248-V296 HydrophobicContact CB-CG1 4.19Å; K248-V296 PolarHBondContact N-O 3.01Å; K248-V296 PolarHBondContact O-N 3.14Å; I250-V296 HydrophobicContact CD1-CG1 4.31Å; V296-W301 HydrophobicContact CB-CB 4.11Å; V296-W301 HydrophobicContact CG2-CB 4.15Å
297	N	93	Very high	95.9	Very high	17 Å²	17	44.3 Å²	44.3	9%	0.091	22%	0.22	C	C	.	.			trans	-131.1	-179.6	162.4	72	3.1	0	0	0	109.9	G215 A217 P245 I299 G300	G215-N297 PolarHBondContact O-ND2 3.09Å; A217-N297 HydrophobicContact CB-CB 4.38Å; A217-N297 PolarHBondContact N-ND2 2.96Å; A217-N297 PolarHBondContact N-OD1 2.76Å; A217-N297 VanDerWaalsContact N-OD1 3.17Å; P245-N297 WeakPolarHBondContact O-CB 3.36Å; P245-N297 PolarHBondContact O-ND2 3.04Å; N297-I299 PolarHBondContact O-N 2.84Å; N297-I299 PolarHBondContact OD1-N 3.12Å; N297-G300 PolarHBondContact N-O 3.1Å; N297-G300 PolarHBondContact O-N 2.78Å; N297-G300 VanDerWaalsContact O-O 3.11Å; N297-G300 PolarHBondContact OD1-N 2.96Å; N297-G300 PolarHBondContact OD1-O 3.34Å
298	E	91.7	Very high	96	Very high	131 Å²	131	44.2 Å²	44.2	61%	0.612	22%	0.219	S	C	*	.	S	Bend	trans	-66.8	-17.7	-176.7	65.6	-176.2	-173.3	0	0	114.5	R214 P245	R214-E298 IonicContact CZ-OE1 2.66Å; R214-E298 IonicContact NH1-OE1 3.56Å; R214-E298 PolarHBondContact NH1-OE1 3.08Å; R214-E298 IonicContact NH2-OE1 2.62Å; R214-E298 PolarHBondContact NH2-OE1 2.84Å; P245-E298 HydrophobicContact CG-CG 3.81Å; P245-E298 WeakPolarHBondContact CG-OE1 3Å
299	I	92.7	Very high	96	Very high	71 Å²	71	43.9 Å²	43.9	36%	0.364	22%	0.218	S	C	.	.	S	Bend	trans	-89.8	-35.2	-178.9	-55.3	177.3	0	0	0	110.4	R214 K216 H244 N297	R214-I299 HydrophobicContact CB-CD1 3.83Å; K216-I299 HydrophobicContact CB-CB 4.27Å; K216-I299 HydrophobicContact CB-CG2 3.95Å; H244-I299 VanDerWaalsContact O-CD1 3.31Å; H244-I299 WeakPolarHBondContact O-CD1 3.02Å; N297-I299 PolarHBondContact O-N 2.84Å; N297-I299 PolarHBondContact OD1-N 3.12Å
300	G	94.5	Very high	96	Very high	17 Å²	17	43.8 Å²	43.8	18%	0.175	22%	0.217	C	C	.	.			trans	177.6	-171	177.9	0	0	0	0	0	113.4	N297	N297-G300 PolarHBondContact N-O 3.1Å; N297-G300 PolarHBondContact O-N 2.78Å; N297-G300 VanDerWaalsContact O-O 3.11Å; N297-G300 PolarHBondContact OD1-N 2.96Å; N297-G300 PolarHBondContact OD1-O 3.34Å
301	W	96.3	Very high	95.8	Very high	153 Å²	153	45.6 Å²	45.6	58%	0.58	22%	0.222	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-142.2	162.2	-175.7	66.9	-82.2	0	0	0	110.8	I294 A295 V296 E303	I294-W301 HydrophobicContact CG2-CE3 4.47Å; A295-W301 CarbonylContact O-C 3.59Å; A295-W301 WeakPolarHBondContact O-CA 3.37Å; A295-W301 VanDerWaalsContact O-CB 3.27Å; A295-W301 WeakPolarHBondContact O-CB 3.38Å; V296-W301 HydrophobicContact CB-CB 4.11Å; V296-W301 HydrophobicContact CG2-CB 4.15Å; W301-E303 HydrophobicContact CE3-CB 4.48Å; W301-E303 HydrophobicContact CZ3-CB 4.13Å; W301-E303 HydrophobicContact CZ3-CG 3.87Å
302	D	96.6	Very high	95.6	Very high	31 Å²	31	47.6 Å²	47.6	17%	0.166	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.1	152.8	175.9	-170	27.2	0	0	0	109.8	A217 I219 K222 A295	A217-D302 VanDerWaalsContact O-CB 3.24Å; A217-D302 WeakPolarHBondContact O-CB 3.31Å; I219-D302 WeakPolarHBondContact CB-OD2 3.28Å; I219-D302 HydrophobicContact CG1-CB 4.46Å; I219-D302 PolarHBondContact N-OD2 2.97Å; K222-D302 WeakPolarHBondContact CE-OD2 3.46Å; K222-D302 IonicContact NZ-OD1 2.6Å; K222-D302 PolarHBondContact NZ-OD1 2.87Å; K222-D302 IonicContact NZ-OD2 3.16Å; K222-D302 PolarHBondContact NZ-OD2 2.83Å; A295-D302 PolarHBondContact N-O 2Å; A295-D302 PolarHBondContact O-N 2.9Å
303	E	96.7	Very high	95	Very high	93 Å²	93	52.6 Å²	52.6	44%	0.435	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	152	-174.9	71.4	177.7	-171	0	0	113.9	K222 T292 C293 I294 W301	K222-E303 PolarHBondContact NZ-O 2.98Å; T292-E303 HydrophobicContact CG2-CB 4.29Å; C293-E303 CarbonylContact O-C 3.56Å; C293-E303 VanDerWaalsContact O-CA 3.26Å; C293-E303 WeakPolarHBondContact O-CA 3.49Å; I294-E303 HydrophobicContact CG1-CB 4.07Å; W301-E303 HydrophobicContact CE3-CB 4.48Å; W301-E303 HydrophobicContact CZ3-CB 4.13Å; W301-E303 HydrophobicContact CZ3-CG 3.87Å
304	S	97.2	Very high	94.5	Very high	7 Å²	7	57.3 Å²	57.3	5%	0.049	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	131.5	179.5	-178.6	0	0	0	0	110.3	Y223 T292 C293	Y223-S304 WeakPolarHBondContact CD2-O 3.37Å; Y223-S304 WeakPolarHBondContact CD2-OG 3.35Å; Y223-S304 WeakPolarHBondContact CE2-O 3.46Å; Y223-S304 VanDerWaalsContact CG-OG 3.28Å; Y223-S304 PolarHBondContact N-OG 3.17Å; T292-S304 WeakPolarHBondContact CA-O 3.47Å; C293-S304 PolarHBondContact N-O 2.84Å; C293-S304 PolarHBondContact O-N 2.9Å
305	A	96.9	Very high	93.9	Very high	41 Å²	41	58.1 Å²	58.1	34%	0.339	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	138.4	-174.4	0	0	0	0	0	112.7	Y223 L290 Y291 T292	Y223-A305 WeakPolarHBondContact CB-O 3.2Å; L290-A305 HydrophobicContact CD1-CB 3.93Å; L290-A305 HydrophobicContact CD2-CB 4.33Å; L290-A305 HydrophobicContact CG-CB 4.13Å; Y291-A305 CarbonylContact O-C 3.53Å; Y291-A305 WeakPolarHBondContact O-CA 3.35Å; T292-A305 HydrophobicContact CG2-CB 4.17Å; T292-A305 WeakPolarHBondContact OG1-CB 3.25Å
306	V	97.2	Very high	93.1	Very high	4 Å²	4	61.6 Å²	61.6	2%	0.024	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	133.3	178.7	62.6	0	0	0	0	110.8	Y223 K227 I237 Y291 L308	Y223-V306 HydrophobicContact CD2-CB 3.67Å; Y223-V306 HydrophobicContact CD2-CG1 3.83Å; Y223-V306 HydrophobicContact CE2-CB 4.45Å; Y223-V306 HydrophobicContact CE2-CG1 4.12Å; Y223-V306 HydrophobicContact CG-CB 3.73Å; Y223-V306 HydrophobicContact CG-CG1 4.21Å; K227-V306 HydrophobicContact CB-CG2 4.38Å; K227-V306 HydrophobicContact CD-CG2 4.31Å; K227-V306 HydrophobicContact CG-CG2 3.95Å; I237-V306 HydrophobicContact CD1-CG1 4.08Å; I237-V306 HydrophobicContact CG2-CG1 3.76Å; Y291-V306 PolarHBondContact N-O 3.37Å; Y291-V306 PolarHBondContact O-N 2.77Å; V306-L308 PolarHBondContact O-N 3.09Å
307	L	97.6	Very high	92.8	Very high	62 Å²	62	63.3 Å²	63.3	33%	0.325	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	113.6	174.6	-178.7	64.3	0	0	0	109.8	G225 S226 K227 L290 R309	G225-L307 PolarHBondContact O-N 3.17Å; S226-L307 CarbonylContact C-O 3.5Å; S226-L307 WeakPolarHBondContact CA-O 3.48Å; S226-L307 VanDerWaalsContact CB-O 3.32Å; S226-L307 WeakPolarHBondContact CB-O 3.31Å; K227-L307 PolarHBondContact N-O 2.88Å; L290-L307 HydrophobicContact CD1-CB 4.45Å; L307-R309 HydrophobicContact CD2-CG 4.31Å; L307-R309 HydrophobicContact CG-CG 4.18Å
308	L	97.3	Very high	92.6	Very high	2 Å²	2	70.2 Å²	70.2	1%	0.01	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	123.8	173.4	-171.6	151.3	0	0	0	109.5	F229 A235 I237 L280 L283 R288 A289 Y291 V306 V310	F229-L308 HydrophobicContact CD2-CD1 4.44Å; F229-L308 HydrophobicContact CD2-CG 4.18Å; F229-L308 HydrophobicContact CE2-CD1 4.35Å; F229-L308 HydrophobicContact CE2-CG 4.39Å; A235-L308 HydrophobicContact CB-CD1 3.93Å; I237-L308 HydrophobicContact CD1-CD1 4.13Å; L280-L308 HydrophobicContact CD1-CD1 4.19Å; L283-L308 HydrophobicContact CD2-CD1 4.32Å; L283-L308 HydrophobicContact CD2-CD2 4.2Å; R288-L308 WeakPolarHBondContact CA-O 3.38Å; A289-L308 PolarHBondContact O-N 3.38Å; Y291-L308 HydrophobicContact CD2-CB 3.63Å; Y291-L308 HydrophobicContact CD2-CD1 4.29Å; Y291-L308 HydrophobicContact CE2-CB 3.64Å; Y291-L308 HydrophobicContact CE2-CD1 3.99Å; Y291-L308 HydrophobicContact CE2-CG 4.26Å; V306-L308 PolarHBondContact O-N 3.09Å; L308-V310 HydrophobicContact CD2-CG2 3.47Å; L308-V310 VanDerWaalsContact CD2-CG2 3.47Å
309	R	96.6	Very high	92.5	Very high	120 Å²	120	67.8 Å²	67.8	45%	0.453	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	128.5	177.7	-67.1	-179.5	172.5	169.9	-2.1	109.8	S226 K227 N228 F229 L307	S226-R309 PolarHBondContact OG-NH1 2.76Å; K227-R309 PolarHBondContact O-N 3.11Å; N228-R309 CarbonylContact C-O 3.47Å; N228-R309 WeakPolarHBondContact CA-O 3.42Å; N228-R309 WeakPolarHBondContact OD1-CB 3.31Å; N228-R309 WeakPolarHBondContact OD1-CD 3.48Å; F229-R309 PolarHBondContact N-O 2.88Å; L307-R309 HydrophobicContact CD2-CG 4.31Å; L307-R309 HydrophobicContact CG-CG 4.18Å
310	V	96.4	Very high	92.5	Very high	2 Å²	2	71.3 Å²	71.3	1%	0.012	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	126.7	174.5	-175.2	0	0	0	0	108.6	F229 E231 L283 R284 F285 R288 L308	F229-V310 CarbonylContact O-C 3.58Å; F229-V310 WeakPolarHBondContact O-CA 3.41Å; E231-V310 HydrophobicContact CB-CG1 4.06Å; L283-V310 HydrophobicContact CB-CG1 4.28Å; L283-V310 HydrophobicContact CB-CG2 4.13Å; L283-V310 HydrophobicContact CD1-CG2 4.44Å; L283-V310 HydrophobicContact CD2-CG2 4.41Å; R284-V310 WeakPolarHBondContact O-CG2 3.37Å; F285-V310 HydrophobicContact CD1-CB 4.4Å; F285-V310 HydrophobicContact CD1-CG1 4.21Å; F285-V310 HydrophobicContact CE1-CG1 4.35Å; R288-V310 HydrophobicContact CG-CB 3.94Å; R288-V310 HydrophobicContact CG-CG2 4.03Å; R288-V310 PolarHBondContact NE-O 2.8Å; R288-V310 PolarHBondContact NH2-O 3.22Å; L308-V310 HydrophobicContact CD2-CG2 3.47Å; L308-V310 VanDerWaalsContact CD2-CG2 3.47Å
311	K	93.1	Very high	92.4	Very high	110 Å²	110	74.6 Å²	74.6	48%	0.478	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	148.1	178.4	-66.1	-177	-175.2	180	0	110.4	F229 M230 E231	F229-K311 PolarHBondContact O-N 2.66Å; M230-K311 CarbonylContact C-O 3.57Å; M230-K311 WeakPolarHBondContact CA-O 3.18Å; M230-K311 HydrophobicContact SD-CB 3.84Å; E231-K311 PolarHBondContact N-O 3.43Å
312	D	91.1	Very high	92.2	Very high	43 Å²	43	69 Å²	69	23%	0.23	36%	0.362	C	S	.	.			trans	-66.2	134.1	174.5	178.6	-7.3	0	0	0	110	F285 L314 A315 W318	F285-D312 HydrophobicContact CE1-CB 4.26Å; F285-D312 HydrophobicContact CZ-CB 3.77Å; D312-L314 PolarHBondContact O-N 2.91Å; D312-L314 PolarHBondContact OD1-N 3.08Å; D312-A315 HydrophobicContact CB-CB 4.1Å; D312-A315 WeakPolarHBondContact O-CB 3.39Å; D312-A315 PolarHBondContact O-N 3.24Å; D312-A315 VanDerWaalsContact O-N 3.09Å; D312-W318 PolarHBondContact OD2-NE1 2.87Å
313	K	85.2	Confident	92.2	Very high	119 Å²	119	72.7 Å²	72.7	52%	0.517	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-33.1	174.7	-69.9	-167.3	-170.4	-175.8	0	112.9	M230 E231	M230-K313 HydrophobicContact CB-CG 4.38Å; M230-K313 HydrophobicContact CE-CB 4.48Å; M230-K313 HydrophobicContact CE-CG 4.5Å; E231-K313 WeakPolarHBondContact O-CE 3.32Å; E231-K313 PolarHBondContact O-NZ 3.01Å
314	L	86.3	Confident	92.1	Very high	99 Å²	99	73.3 Å²	73.3	52%	0.518	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.3	7.4	-177.4	-51.7	177.3	0	0	0	111.8	D312 A316 L317 W318	D312-L314 PolarHBondContact O-N 2.91Å; D312-L314 PolarHBondContact OD1-N 3.08Å; L314-A316 PolarHBondContact O-N 2.03Å; L314-A316 VanDerWaalsContact O-N 3.11Å; L314-L317 HydrophobicContact CB-CD1 4.16Å; L314-L317 HydrophobicContact CD2-CD1 3.65Å; L314-L317 HydrophobicContact CG-CD1 4.41Å; L314-L317 WeakPolarHBondContact O-CB 3.49Å; L314-L317 PolarHBondContact O-N 3.35Å; L314-W318 VanDerWaalsContact O-CD1 3.31Å
315	A	83.7	Confident	92.1	Very high	48 Å²	48	76.8 Å²	76.8	40%	0.397	41%	0.407	S	S	.	.	G	3₁₀ helix	trans	-48.2	-42.1	176.6	0	0	0	0	0	112.3	D312 L317 W318	D312-A315 HydrophobicContact CB-CB 4.1Å; D312-A315 WeakPolarHBondContact O-CB 3.39Å; D312-A315 PolarHBondContact O-N 3.24Å; D312-A315 VanDerWaalsContact O-N 3.09Å; A315-L317 VanDerWaalsContact C-N 3.26Å; A315-L317 PolarHBondContact O-N 3.13Å; A315-W318 PolarHBondContact O-N 2.86Å
316	A	81.1	Confident	92	Very high	72 Å²	72	80.4 Å²	80.4	60%	0.595	42%	0.417	S	S	*	.	G	3₁₀ helix	trans	-71.1	-16.4	-179.3	0	0	0	0	0	114	L314 F320	L314-A316 PolarHBondContact O-N 2.03Å; L314-A316 VanDerWaalsContact O-N 3.11Å; A316-F320 VanDerWaalsContact O-CD2 3.23Å; A316-F320 WeakPolarHBondContact O-CD2 3.49Å; A316-F320 VanDerWaalsContact O-CE2 3.29Å; A316-F320 WeakPolarHBondContact O-CE2 3.44Å
317	L	88.1	Confident	92	Very high	88 Å²	88	83.8 Å²	83.8	46%	0.461	44%	0.438	S	S	.	.	G	3₁₀ helix	trans	-84.8	-27.3	178.9	-63.7	178.5	0	0	0	112.8	L314 A315 F320 L321	L314-L317 HydrophobicContact CB-CD1 4.16Å; L314-L317 HydrophobicContact CD2-CD1 3.65Å; L314-L317 HydrophobicContact CG-CD1 4.41Å; L314-L317 WeakPolarHBondContact O-CB 3.49Å; L314-L317 PolarHBondContact O-N 3.35Å; A315-L317 VanDerWaalsContact C-N 3.26Å; A315-L317 PolarHBondContact O-N 3.13Å; L317-F320 PolarHBondContact O-N 2.94Å; L317-L321 HydrophobicContact CB-CD1 4.42Å; L317-L321 PolarHBondContact O-N 2.99Å
318	W	88	Confident	92	Very high	161 Å²	161	84.7 Å²	84.7	61%	0.61	45%	0.446	S	S	*	.	H	α-helix	trans	-54.2	-42.3	-176.5	-74.5	99.4	0	0	0	114.5	D312 L314 A315 F320 L321 G322	D312-W318 PolarHBondContact OD2-NE1 2.87Å; L314-W318 VanDerWaalsContact O-CD1 3.31Å; A315-W318 PolarHBondContact O-N 2.86Å; W318-F320 VanDerWaalsContact C-N 3.35Å; W318-F320 PolarHBondContact O-N 3.38Å; W318-L321 PolarHBondContact O-N 2.8Å; W318-G322 PolarHBondContact O-N 3.19Å
319	P	90.5	Very high	92	Very high	81 Å²	81	88.3 Å²	88.3	53%	0.526	46%	0.464	S	S	.	.	H	α-helix	trans	-61.6	-40.8	175.5	-24.2	35.2	0	0	0	113	G322 I323	P319-G322 PolarHBondContact O-N 3.04Å; P319-I323 VanDerWaalsContact O-CG1 3.31Å; P319-I323 WeakPolarHBondContact O-CG1 3.48Å; P319-I323 PolarHBondContact O-N 2.83Å
320	F	92.2	Very high	92	Very high	145 Å²	145	87.2 Å²	87.2	64%	0.636	47%	0.466	S	S	*	.	H	α-helix	trans	-69	-39.6	178.3	-59.2	-75	0	0	0	111.8	A316 L317 W318 G322 I323 L324	A316-F320 VanDerWaalsContact O-CD2 3.23Å; A316-F320 WeakPolarHBondContact O-CD2 3.49Å; A316-F320 VanDerWaalsContact O-CE2 3.29Å; A316-F320 WeakPolarHBondContact O-CE2 3.44Å; L317-F320 PolarHBondContact O-N 2.94Å; W318-F320 VanDerWaalsContact C-N 3.35Å; W318-F320 PolarHBondContact O-N 3.38Å; F320-G322 VanDerWaalsContact C-N 3.34Å; F320-I323 PolarHBondContact O-N 2.9Å; F320-L324 WeakPolarHBondContact O-CB 3.37Å; F320-L324 PolarHBondContact O-N 3.48Å
321	L	92.2	Very high	91.9	Very high	85 Å²	85	92.2 Å²	92.2	45%	0.445	49%	0.491	S	S	.	.	H	α-helix	trans	-63.2	-41.2	173.7	-70.4	171.6	0	0	0	111.1	L317 W318 L324 V325	L317-L321 HydrophobicContact CB-CD1 4.42Å; L317-L321 PolarHBondContact O-N 2.99Å; W318-L321 PolarHBondContact O-N 2.8Å; L321-L324 PolarHBondContact O-N 2.82Å; L321-V325 WeakPolarHBondContact O-CB 3.49Å; L321-V325 VanDerWaalsContact O-CG2 3.24Å; L321-V325 WeakPolarHBondContact O-CG2 3.01Å; L321-V325 PolarHBondContact O-N 2.96Å
322	G	93.2	Very high	92.1	Very high	37 Å²	37	90.3 Å²	90.3	38%	0.381	49%	0.491	S	S	.	.	H	α-helix	trans	-59.6	-49.5	173.9	0	0	0	0	0	112.4	W318 P319 F320 L324 V325 E326	W318-G322 PolarHBondContact O-N 3.19Å; P319-G322 PolarHBondContact O-N 3.04Å; F320-G322 VanDerWaalsContact C-N 3.34Å; G322-L324 VanDerWaalsContact C-N 3.33Å; G322-L324 PolarHBondContact O-N 2.81Å; G322-V325 PolarHBondContact O-N 2.8Å; G322-E326 WeakPolarHBondContact O-CG 3.19Å; G322-E326 PolarHBondContact O-N 2.73Å
323	I	95.2	Very high	92.4	Very high	108 Å²	108	92.1 Å²	92.1	55%	0.554	50%	0.5	S	S	*	.	H	α-helix	trans	-60.8	-43.3	176.7	-66.3	163.9	0	0	0	111.1	P319 F320 V325 E326 V327	P319-I323 VanDerWaalsContact O-CG1 3.31Å; P319-I323 WeakPolarHBondContact O-CG1 3.48Å; P319-I323 PolarHBondContact O-N 2.83Å; F320-I323 PolarHBondContact O-N 2.9Å; I323-V325 VanDerWaalsContact C-N 3.34Å; I323-V325 PolarHBondContact O-N 3.04Å; I323-E326 PolarHBondContact O-N 2.77Å; I323-V327 HydrophobicContact CG2-CG2 4.43Å; I323-V327 WeakPolarHBondContact O-CG2 3.45Å; I323-V327 PolarHBondContact O-N 3.23Å
324	L	95.7	Very high	92.8	Very high	105 Å²	105	90 Å²	90	55%	0.55	49%	0.494	S	S	.	.	H	α-helix	trans	-61.6	-43.3	178.5	-176.1	67	0	0	0	111.4	F320 L321 G322 V327 V328	F320-L324 WeakPolarHBondContact O-CB 3.37Å; F320-L324 PolarHBondContact O-N 3.48Å; L321-L324 PolarHBondContact O-N 2.82Å; G322-L324 VanDerWaalsContact C-N 3.33Å; G322-L324 PolarHBondContact O-N 2.81Å; L324-V327 PolarHBondContact O-N 3.21Å; L324-V328 VanDerWaalsContact O-CG2 3.27Å; L324-V328 WeakPolarHBondContact O-CG2 3.29Å; L324-V328 PolarHBondContact O-N 3.42Å
325	V	96.6	Very high	93.3	Very high	81 Å²	81	91.9 Å²	91.9	49%	0.491	50%	0.498	S	S	.	.	H	α-helix	trans	-62.1	-46.1	176.3	168.8	0	0	0	0	110.9	L321 G322 I323 V327 V328 I329	L321-V325 WeakPolarHBondContact O-CB 3.49Å; L321-V325 VanDerWaalsContact O-CG2 3.24Å; L321-V325 WeakPolarHBondContact O-CG2 3.01Å; L321-V325 PolarHBondContact O-N 2.96Å; G322-V325 PolarHBondContact O-N 2.8Å; I323-V325 VanDerWaalsContact C-N 3.34Å; I323-V325 PolarHBondContact O-N 3.04Å; V325-V327 PolarHBondContact O-N 2.88Å; V325-V328 PolarHBondContact O-N 2.01Å; V325-I329 HydrophobicContact CG1-CD1 3.7Å; V325-I329 HydrophobicContact CG1-CG1 4.37Å; V325-I329 VanDerWaalsContact O-CG1 3.27Å; V325-I329 WeakPolarHBondContact O-CG1 3.48Å; V325-I329 PolarHBondContact O-N 3.01Å
326	E	95.9	Very high	93.8	Very high	117 Å²	117	94.4 Å²	94.4	55%	0.547	50%	0.501	S	S	.	.	H	α-helix	trans	-58.6	-45.1	176.2	-72.6	-67.4	165.8	0	0	112.1	G322 I323 V328 I329 L330	G322-E326 WeakPolarHBondContact O-CG 3.19Å; G322-E326 PolarHBondContact O-N 2.73Å; I323-E326 PolarHBondContact O-N 2.77Å; E326-V328 PolarHBondContact O-N 2.83Å; E326-I329 PolarHBondContact O-N 2.85Å; E326-L330 WeakPolarHBondContact O-CG 3.46Å; E326-L330 PolarHBondContact O-N 2.91Å
327	V	96.7	Very high	94.4	Very high	75 Å²	75	97.2 Å²	97.2	46%	0.455	50%	0.5	S	S	.	.	H	α-helix	trans	-62.7	-42.5	176.8	172	0	0	0	0	111.3	I323 L324 V325 L330 M331	I323-V327 HydrophobicContact CG2-CG2 4.43Å; I323-V327 WeakPolarHBondContact O-CG2 3.45Å; I323-V327 PolarHBondContact O-N 3.23Å; L324-V327 PolarHBondContact O-N 3.21Å; V325-V327 PolarHBondContact O-N 2.88Å; V327-L330 PolarHBondContact O-N 3.09Å; V327-M331 HydrophobicContact CG1-CG 4.39Å; V327-M331 WeakPolarHBondContact O-CB 3.38Å; V327-M331 VanDerWaalsContact O-CG 3.27Å; V327-M331 WeakPolarHBondContact O-CG 3.22Å; V327-M331 PolarHBondContact O-N 3.48Å
328	V	96.7	Very high	94.6	Very high	81 Å²	81	98.4 Å²	98.4	49%	0.491	50%	0.503	S	S	.	.	H	α-helix	trans	-65.1	-39.6	177.6	170.2	0	0	0	0	111.5	L324 V325 E326 S332	L324-V328 VanDerWaalsContact O-CG2 3.27Å; L324-V328 WeakPolarHBondContact O-CG2 3.29Å; L324-V328 PolarHBondContact O-N 3.42Å; V325-V328 PolarHBondContact O-N 2.01Å; E326-V328 PolarHBondContact O-N 2.83Å; V328-S332 WeakPolarHBondContact O-CB 3.01Å; V328-S332 PolarHBondContact O-N 3.49Å; V328-S332 PolarHBondContact O-OG 3.49Å
329	I	97	Very high	94.8	Very high	78 Å²	78	96.1 Å²	96.1	40%	0.4	50%	0.497	S	S	.	.	H	α-helix	trans	-63.1	-49.4	175.6	-70.2	167.5	0	0	0	110.1	V325 E326 M331 S332 I333	V325-I329 HydrophobicContact CG1-CD1 3.7Å; V325-I329 HydrophobicContact CG1-CG1 4.37Å; V325-I329 VanDerWaalsContact O-CG1 3.27Å; V325-I329 WeakPolarHBondContact O-CG1 3.48Å; V325-I329 PolarHBondContact O-N 3.01Å; E326-I329 PolarHBondContact O-N 2.85Å; I329-M331 PolarHBondContact O-N 2.89Å; I329-S332 WeakPolarHBondContact O-CB 3.39Å; I329-S332 PolarHBondContact O-N 3.01Å; I329-I333 HydrophobicContact CG2-CD1 3.74Å; I329-I333 HydrophobicContact CG2-CG1 4.43Å; I329-I333 VanDerWaalsContact O-CG1 3.29Å; I329-I333 WeakPolarHBondContact O-CG1 3.44Å; I329-I333 PolarHBondContact O-N 3.03Å
330	L	96.6	Very high	94.8	Very high	96 Å²	96	99 Å²	99	50%	0.503	50%	0.498	S	S	.	.	H	α-helix	trans	-59.2	-45.9	177.3	-74.4	172.8	0	0	0	112.2	E326 V327 S332 I333 I334	E326-L330 WeakPolarHBondContact O-CG 3.46Å; E326-L330 PolarHBondContact O-N 2.91Å; V327-L330 PolarHBondContact O-N 3.09Å; L330-S332 VanDerWaalsContact C-N 3.33Å; L330-S332 PolarHBondContact O-N 3.14Å; L330-I333 PolarHBondContact O-N 2.65Å; L330-I334 VanDerWaalsContact O-CG1 3.29Å; L330-I334 WeakPolarHBondContact O-CG1 3.18Å; L330-I334 PolarHBondContact O-N 2.92Å
331	M	96.2	Very high	94.8	Very high	108 Å²	108	99.8 Å²	99.8	53%	0.532	50%	0.496	S	S	.	.	H	α-helix	trans	-61	-41.2	175.9	-72.7	-63.1	105.2	0	0	112	V327 I329 I334 F335	V327-M331 HydrophobicContact CG1-CG 4.39Å; V327-M331 WeakPolarHBondContact O-CB 3.38Å; V327-M331 VanDerWaalsContact O-CG 3.27Å; V327-M331 WeakPolarHBondContact O-CG 3.22Å; V327-M331 PolarHBondContact O-N 3.48Å; I329-M331 PolarHBondContact O-N 2.89Å; M331-I334 HydrophobicContact CE-CD1 3.68Å; M331-I334 PolarHBondContact O-N 3.45Å; M331-F335 VanDerWaalsContact O-CB 3.28Å; M331-F335 WeakPolarHBondContact O-CB 3.21Å; M331-F335 PolarHBondContact O-N 2.71Å
332	S	96.4	Very high	94.7	Very high	69 Å²	69	100.8 Å²	100.8	48%	0.483	50%	0.5	S	S	.	.	H	α-helix	trans	-65	-40.4	177.5	-60.5	0	0	0	0	112	V328 I329 L330 F336	V328-S332 WeakPolarHBondContact O-CB 3.01Å; V328-S332 PolarHBondContact O-N 3.49Å; V328-S332 PolarHBondContact O-OG 3.49Å; I329-S332 WeakPolarHBondContact O-CB 3.39Å; I329-S332 PolarHBondContact O-N 3.01Å; L330-S332 VanDerWaalsContact C-N 3.33Å; L330-S332 PolarHBondContact O-N 3.14Å; S332-F336 VanDerWaalsContact O-CB 3.32Å; S332-F336 WeakPolarHBondContact O-CB 3.33Å; S332-F336 PolarHBondContact O-N 3.4Å
333	I	96.4	Very high	94.5	Very high	81 Å²	81	104.7 Å²	104.7	42%	0.415	51%	0.506	S	S	.	.	H	α-helix	trans	-64.4	-49.3	175.6	-70	169	0	0	0	110.5	I329 L330 F335 F336 F337	I329-I333 HydrophobicContact CG2-CD1 3.74Å; I329-I333 HydrophobicContact CG2-CG1 4.43Å; I329-I333 VanDerWaalsContact O-CG1 3.29Å; I329-I333 WeakPolarHBondContact O-CG1 3.44Å; I329-I333 PolarHBondContact O-N 3.03Å; L330-I333 PolarHBondContact O-N 2.65Å; I333-F335 PolarHBondContact O-N 3.01Å; I333-F336 PolarHBondContact O-N 2.68Å; I333-F337 HydrophobicContact CG2-CD2 3.56Å; I333-F337 HydrophobicContact CG2-CE2 3.51Å; I333-F337 VanDerWaalsContact O-CD2 3.22Å; I333-F337 WeakPolarHBondContact O-CD2 3.14Å; I333-F337 PolarHBondContact O-N 3Å
334	I	95.2	Very high	94.1	Very high	76 Å²	76	106 Å²	106	39%	0.39	51%	0.508	S	S	.	.	H	α-helix	trans	-58.3	-50.6	178.1	-69.7	164.2	0	0	0	110.3	L330 M331 F336 F337 E338	L330-I334 VanDerWaalsContact O-CG1 3.29Å; L330-I334 WeakPolarHBondContact O-CG1 3.18Å; L330-I334 PolarHBondContact O-N 2.92Å; M331-I334 HydrophobicContact CE-CD1 3.68Å; M331-I334 PolarHBondContact O-N 3.45Å; I334-F336 VanDerWaalsContact C-N 3.27Å; I334-F336 PolarHBondContact O-N 3.42Å; I334-F337 PolarHBondContact O-N 3.25Å; I334-F337 VanDerWaalsContact O-N 3.12Å; I334-E338 HydrophobicContact CG2-CG 4.31Å; I334-E338 WeakPolarHBondContact O-CG 3.49Å; I334-E338 PolarHBondContact O-N 2.94Å
335	F	95.5	Very high	93.7	Very high	138 Å²	138	104.2 Å²	104.2	61%	0.605	50%	0.497	S	S	*	.	H	α-helix	trans	-57.6	-40.4	178.1	-179.8	-100.8	0	0	0	112.2	M331 I333 K339	M331-F335 VanDerWaalsContact O-CB 3.28Å; M331-F335 WeakPolarHBondContact O-CB 3.21Å; M331-F335 PolarHBondContact O-N 2.71Å; I333-F335 PolarHBondContact O-N 3.01Å; F335-K339 HydrophobicContact CE1-CD 4.31Å; F335-K339 VanDerWaalsContact O-CB 3.22Å; F335-K339 WeakPolarHBondContact O-CB 3.41Å; F335-K339 PolarHBondContact O-N 3.43Å
336	F	94.7	Very high	93.2	Very high	101 Å²	101	105.9 Å²	105.9	44%	0.443	50%	0.499	S	S	.	.	H	α-helix	trans	-66.4	-41.3	176.8	-176.5	-102.8	0	0	0	112.7	S332 I333 I334 R340	S332-F336 VanDerWaalsContact O-CB 3.32Å; S332-F336 WeakPolarHBondContact O-CB 3.33Å; S332-F336 PolarHBondContact O-N 3.4Å; I333-F336 PolarHBondContact O-N 2.68Å; I334-F336 VanDerWaalsContact C-N 3.27Å; I334-F336 PolarHBondContact O-N 3.42Å; F336-R340 HydrophobicContact CE1-CG 4.36Å; F336-R340 VanDerWaalsContact CZ-NH2 3.33Å; F336-R340 WeakPolarHBondContact O-CB 3.09Å; F336-R340 WeakPolarHBondContact O-CG 3.27Å; F336-R340 PolarHBondContact O-N 2.63Å
337	F	92.9	Very high	92.7	Very high	131 Å²	131	106.5 Å²	106.5	58%	0.575	50%	0.502	S	S	*	.	H	α-helix	trans	-67	-43.6	175.5	-84.1	-69.1	0	0	0	112.3	I333 I334 R340 R341	I333-F337 HydrophobicContact CG2-CD2 3.56Å; I333-F337 HydrophobicContact CG2-CE2 3.51Å; I333-F337 VanDerWaalsContact O-CD2 3.22Å; I333-F337 WeakPolarHBondContact O-CD2 3.14Å; I333-F337 PolarHBondContact O-N 3Å; I334-F337 PolarHBondContact O-N 3.25Å; I334-F337 VanDerWaalsContact O-N 3.12Å; F337-R340 PolarHBondContact O-N 3.21Å; F337-R341 WeakPolarHBondContact O-CB 3.38Å; F337-R341 PolarHBondContact O-N 2.57Å
338	E	92.7	Very high	92.1	Very high	113 Å²	113	109 Å²	109	53%	0.528	51%	0.509	S	S	.	.	H	α-helix	trans	-61.4	-45.7	174.8	-73.5	-175.5	164.7	0	0	111.2	I334 R340 R341 M342	I334-E338 HydrophobicContact CG2-CG 4.31Å; I334-E338 WeakPolarHBondContact O-CG 3.49Å; I334-E338 PolarHBondContact O-N 2.94Å; E338-R340 VanDerWaalsContact C-N 3.31Å; E338-R340 PolarHBondContact O-N 3.11Å; E338-R341 WeakPolarHBondContact O-CB 3.16Å; E338-R341 PolarHBondContact O-N 2.77Å; E338-R341 VanDerWaalsContact O-N 3.16Å; E338-M342 WeakPolarHBondContact O-CB 3.4Å; E338-M342 VanDerWaalsContact O-CG 3.31Å; E338-M342 WeakPolarHBondContact O-CG 3.44Å; E338-M342 PolarHBondContact O-N 2.82Å
339	K	91.6	Very high	91.4	Very high	112 Å²	112	111.6 Å²	111.6	49%	0.487	52%	0.519	S	S	.	.	H	α-helix	trans	-61.7	-38.8	176.1	-172.4	172.7	-174.9	172.8	0	112.2	F335 K343	F335-K339 HydrophobicContact CE1-CD 4.31Å; F335-K339 VanDerWaalsContact O-CB 3.22Å; F335-K339 WeakPolarHBondContact O-CB 3.41Å; F335-K339 PolarHBondContact O-N 3.43Å; K339-K343 WeakPolarHBondContact O-CG 3.35Å; K339-K343 PolarHBondContact O-N 3.37Å
340	R	91.3	Very high	90.7	Very high	143 Å²	143	115.7 Å²	115.7	54%	0.54	54%	0.537	S	S	.	.	H	α-helix	trans	-67	-40.9	173.9	-83.2	-174.2	168.1	-173.7	0	111.9	F336 F337 E338 K343 K344	F336-R340 HydrophobicContact CE1-CG 4.36Å; F336-R340 VanDerWaalsContact CZ-NH2 3.33Å; F336-R340 WeakPolarHBondContact O-CB 3.09Å; F336-R340 WeakPolarHBondContact O-CG 3.27Å; F336-R340 PolarHBondContact O-N 2.63Å; F337-R340 PolarHBondContact O-N 3.21Å; E338-R340 VanDerWaalsContact C-N 3.31Å; E338-R340 PolarHBondContact O-N 3.11Å; R340-K343 PolarHBondContact O-N 3.3Å; R340-K344 PolarHBondContact O-N 3.16Å; R340-K344 VanDerWaalsContact O-N 3.12Å
341	R	91.4	Very high	89.9	Confident	161 Å²	161	114.9 Å²	114.9	61%	0.608	54%	0.544	S	S	*	.	H	α-helix	trans	-62.9	-49.2	177.1	179.4	-177.3	156.5	-166.8	-10.1	111.1	F337 E338 K343 K344 E345	F337-R341 WeakPolarHBondContact O-CB 3.38Å; F337-R341 PolarHBondContact O-N 2.57Å; E338-R341 WeakPolarHBondContact O-CB 3.16Å; E338-R341 PolarHBondContact O-N 2.77Å; E338-R341 VanDerWaalsContact O-N 3.16Å; R341-K343 VanDerWaalsContact C-N 3.27Å; R341-K343 PolarHBondContact O-N 3.18Å; R341-K344 WeakPolarHBondContact O-CB 3.46Å; R341-K344 PolarHBondContact O-N 3.26Å; R341-E345 HydrophobicContact CG-CG 4.46Å; R341-E345 IonicContact CZ-OE1 3.61Å; R341-E345 IonicContact NE-OE1 2.98Å; R341-E345 PolarHBondContact NE-OE1 2.85Å; R341-E345 IonicContact NH2-OE1 3.53Å; R341-E345 PolarHBondContact NH2-OE1 2.96Å; R341-E345 PolarHBondContact O-N 3.1Å
342	M	90.1	Very high	88.9	Confident	105 Å²	105	115.7 Å²	115.7	52%	0.517	55%	0.55	S	S	.	.	H	α-helix	trans	-56.9	-39.5	176.1	-70.9	-66	-65.9	0	0	112.3	E338 Q346	E338-M342 WeakPolarHBondContact O-CB 3.4Å; E338-M342 VanDerWaalsContact O-CG 3.31Å; E338-M342 WeakPolarHBondContact O-CG 3.44Å; E338-M342 PolarHBondContact O-N 2.82Å; M342-Q346 WeakPolarHBondContact O-CB 3.37Å; M342-Q346 WeakPolarHBondContact O-CG 3.04Å; M342-Q346 PolarHBondContact O-N 3.01Å
343	K	89.8	Confident	87.6	Confident	120 Å²	120	117.4 Å²	117.4	52%	0.522	56%	0.559	S	S	.	*	H	α-helix	trans	-64.9	-38.5	174.8	-76.5	-178.2	176.5	-166.4	0	112.8	K339 R340 R341 Q347	K339-K343 WeakPolarHBondContact O-CG 3.35Å; K339-K343 PolarHBondContact O-N 3.37Å; R340-K343 PolarHBondContact O-N 3.3Å; R341-K343 VanDerWaalsContact C-N 3.27Å; R341-K343 PolarHBondContact O-N 3.18Å; K343-Q347 VanDerWaalsContact O-CG 3.27Å; K343-Q347 WeakPolarHBondContact O-CG 3.39Å; K343-Q347 PolarHBondContact O-N 2.83Å; K343-Q347 VanDerWaalsContact O-N 3.1Å
344	K	87	Confident	86.2	Confident	134 Å²	134	123.2 Å²	123.2	58%	0.583	59%	0.585	S	S	*	*	H	α-helix	trans	-68.2	-46.8	176	-73.7	-178.1	169.7	-171.7	0	111.5	R340 R341 Q346 Q347 E348	R340-K344 PolarHBondContact O-N 3.16Å; R340-K344 VanDerWaalsContact O-N 3.12Å; R341-K344 WeakPolarHBondContact O-CB 3.46Å; R341-K344 PolarHBondContact O-N 3.26Å; K344-Q346 VanDerWaalsContact C-N 3.28Å; K344-Q346 PolarHBondContact O-N 2.75Å; K344-Q347 PolarHBondContact O-N 3.1Å; K344-Q347 VanDerWaalsContact O-N 3.09Å; K344-E348 WeakPolarHBondContact O-CG 3.14Å; K344-E348 PolarHBondContact O-N 2.81Å
345	E	87.8	Confident	84	Confident	68 Å²	68	132.2 Å²	132.2	32%	0.318	63%	0.625	S	S	.	*	H	α-helix	trans	-59.8	-39	177.1	-70.5	173.4	174.8	0	0	111.3	R341 E348 L349	R341-E345 HydrophobicContact CG-CG 4.46Å; R341-E345 IonicContact CZ-OE1 3.61Å; R341-E345 IonicContact NE-OE1 2.98Å; R341-E345 PolarHBondContact NE-OE1 2.85Å; R341-E345 IonicContact NH2-OE1 3.53Å; R341-E345 PolarHBondContact NH2-OE1 2.96Å; R341-E345 PolarHBondContact O-N 3.1Å; E345-E348 PolarHBondContact O-N 3.16Å; E345-L349 PolarHBondContact O-N 2.9Å
346	Q	84.9	Confident	83.4	Confident	117 Å²	117	131.9 Å²	131.9	55%	0.547	63%	0.626	S	S	.	*	H	α-helix	trans	-65.3	-40.5	173.2	-78.4	179.1	-21	0	0	113.2	M342 K344 Q350	M342-Q346 WeakPolarHBondContact O-CB 3.37Å; M342-Q346 WeakPolarHBondContact O-CG 3.04Å; M342-Q346 PolarHBondContact O-N 3.01Å; K344-Q346 VanDerWaalsContact C-N 3.28Å; K344-Q346 PolarHBondContact O-N 2.75Å; Q346-Q350 WeakPolarHBondContact O-CB 3.12Å; Q346-Q350 VanDerWaalsContact O-CG 3.27Å; Q346-Q350 WeakPolarHBondContact O-CG 3.34Å; Q346-Q350 PolarHBondContact O-N 3.22Å; Q346-Q350 VanDerWaalsContact O-N 3.11Å
347	Q	85.2	Confident	82.8	Confident	129 Å²	129	133.5 Å²	133.5	60%	0.603	64%	0.635	S	S	*	*	H	α-helix	trans	-67.4	-37.8	176.7	-75.6	173.6	-17.5	0	0	112	K343 K344 Q350 A351	K343-Q347 VanDerWaalsContact O-CG 3.27Å; K343-Q347 WeakPolarHBondContact O-CG 3.39Å; K343-Q347 PolarHBondContact O-N 2.83Å; K343-Q347 VanDerWaalsContact O-N 3.1Å; K344-Q347 PolarHBondContact O-N 3.1Å; K344-Q347 VanDerWaalsContact O-N 3.09Å; Q347-Q350 PolarHBondContact O-N 3.5Å; Q347-A351 WeakPolarHBondContact O-CB 3.42Å; Q347-A351 PolarHBondContact O-N 2.87Å; Q347-A351 VanDerWaalsContact O-N 3.11Å
348	E	84.6	Confident	82.2	Confident	128 Å²	128	133.7 Å²	133.7	60%	0.598	64%	0.639	S	S	*	*	H	α-helix	trans	-68.5	-42.2	176.5	-73.1	172.9	179.5	0	0	111.7	K344 E345 Q350 A351 L352	K344-E348 WeakPolarHBondContact O-CG 3.14Å; K344-E348 PolarHBondContact O-N 2.81Å; E345-E348 PolarHBondContact O-N 3.16Å; E348-Q350 VanDerWaalsContact C-N 3.29Å; E348-Q350 PolarHBondContact O-N 2.92Å; E348-A351 PolarHBondContact O-N 2.82Å; E348-A351 VanDerWaalsContact O-N 3.15Å; E348-L352 PolarHBondContact O-N 3.09Å
349	L	82.8	Confident	81.6	Confident	135 Å²	135	134.9 Å²	134.9	71%	0.707	65%	0.645	S	S	*	*	H	α-helix	trans	-61.9	-36.9	173.9	-110.2	87.1	0	0	0	112.6	E345 A351	E345-L349 PolarHBondContact O-N 2.9Å; L349-A351 VanDerWaalsContact C-N 3.29Å
350	Q	81.8	Confident	81	Confident	165 Å²	165	136.3 Å²	136.3	77%	0.771	66%	0.655	S	S	*	*	H	α-helix	trans	-74.7	-18.2	177.2	-73.8	176.7	-18.1	0	0	113.4	Q346 Q347 E348	Q346-Q350 WeakPolarHBondContact O-CB 3.12Å; Q346-Q350 VanDerWaalsContact O-CG 3.27Å; Q346-Q350 WeakPolarHBondContact O-CG 3.34Å; Q346-Q350 PolarHBondContact O-N 3.22Å; Q346-Q350 VanDerWaalsContact O-N 3.11Å; Q347-Q350 PolarHBondContact O-N 3.5Å; E348-Q350 VanDerWaalsContact C-N 3.29Å; E348-Q350 PolarHBondContact O-N 2.92Å
351	A	79.8	Confident	80.3	Confident	79 Å²	79	135.9 Å²	135.9	65%	0.653	66%	0.663	S	S	*	*	H	α-helix	trans	-94.4	-6.8	-179.1	0	0	0	0	0	113.7	Q347 E348 L349	Q347-A351 WeakPolarHBondContact O-CB 3.42Å; Q347-A351 PolarHBondContact O-N 2.87Å; Q347-A351 VanDerWaalsContact O-N 3.11Å; E348-A351 PolarHBondContact O-N 2.82Å; E348-A351 VanDerWaalsContact O-N 3.15Å; L349-A351 VanDerWaalsContact C-N 3.29Å
352	L	74.5	Confident	79.5	Confident	124 Å²	124	134.1 Å²	134.1	65%	0.649	67%	0.667	S	S	*	*	S	Bend	trans	-71.2	125.1	174.3	-87.6	149.7	0	0	0	109.7	E348 E354	E348-L352 PolarHBondContact O-N 3.09Å; L352-E354 PolarHBondContact O-N 3.46Å
353	P	69.4	Low	78.7	Confident	106 Å²	106	136.3 Å²	136.3	69%	0.688	68%	0.678	S	S	*	*			trans	-66.8	134.4	177.9	16.9	-14.7	0	0	0	109.9	Q355	P353-Q355 PolarHBondContact O-N 3.06Å; P353-Q355 VanDerWaalsContact O-N 3.09Å
354	E	66.9	Low	77.8	Confident	203 Å²	203	137.7 Å²	137.7	95%	0.949	69%	0.692	S	S	*	*			trans	-58.5	112.6	168	-71.1	-175.8	151.3	0	0	108.2	L352	L352-E354 PolarHBondContact O-N 3.46Å
355	Q	48.7	Very low	76.9	Confident	264 Å²	264	138 Å²	138	100%	1.234	70%	0.701	S	S	*	*			trans	-79.9	0	171.9	-82.4	-166	-36.1	0	0	111.5	P353	P353-Q355 PolarHBondContact O-N 3.06Å; P353-Q355 VanDerWaalsContact O-N 3.09Å

Retrieved 355 of 355 residues in 69.8 ms (Link to these results)

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