A0A2J8IMU2_PANTR Loading...

IGLV2-33 isoform 1

AlphaFold DB , UniProt , Accession A0A2J8IMU2, Species PANTR (Pan troglodytes, Chimpanzee), Gene n/a, Length 118 aa.

						>A0A2J8IMU2_PANTR|A0A2J8IMU2
MAWALLLLTLLTQGTGSWAQSALTQPPFVSGAPGQSVTISCTGTSSDVGDYDHVFWYQKRLSTTSRLLIYNVNTRPSGISDLFSGSKSGNMASLTISGLKSEVEANYHCSLYSSSYTF
					

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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	53.3	Low	53.5	Low	253 Å²	253	157.7 Å²	157.7	100%	1.246	85%	0.847	S	S	*	*				0	105.1	0	-79.6	173.2	-174.3	0	0	108.5
2	A	44.7	Very low	53.6	Low	99 Å²	99	154 Å²	154	82%	0.818	83%	0.834	S	S	*	*			trans	-177.9	84.9	163.7	0	0	0	0	0	105.1
3	W	48.3	Very low	53.9	Low	239 Å²	239	153.4 Å²	153.4	91%	0.905	82%	0.822	S	S	*	*				75.4	100.3	109	-150.9	-52.4	0	0	0	112.7	L5	W3-L5 PolarHBondContact O-N 3.32Å
4	A	52.5	Low	53.4	Low	80 Å²	80	147.8 Å²	147.8	66%	0.661	82%	0.819	S	S	*	*			trans	-62.1	118.8	170.1	0	0	0	0	0	110.2	L6	A4-L6 PolarHBondContact O-N 2.9Å
5	L	54.3	Low	53.4	Low	162 Å²	162	146.1 Å²	146.1	85%	0.848	81%	0.814	S	S	*	*			trans	-71.8	96.6	168.7	-70.5	169	0	0	0	108.3	W3 L7	W3-L5 PolarHBondContact O-N 3.32Å; L5-L7 PolarHBondContact O-N 3.42Å
6	L	57.1	Low	53.2	Low	151 Å²	151	140.2 Å²	140.2	79%	0.791	80%	0.797	S	S	*	*			trans	-62.8	105	162.3	-89.5	146.5	0	0	0	108	A4 L8	A4-L6 PolarHBondContact O-N 2.9Å; L6-L8 PolarHBondContact O-N 3.37Å
7	L	58.9	Low	53.2	Low	167 Å²	167	138.5 Å²	138.5	87%	0.874	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-72.7	119.4	166.8	-105.2	110.1	0	0	0	108.8	L5	L5-L7 PolarHBondContact O-N 3.42Å
8	L	55.3	Low	53.1	Low	163 Å²	163	144.3 Å²	144.3	85%	0.853	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-55.1	139.5	179.1	-89.5	69.5	0	0	0	111.5	L6 L10	L6-L8 PolarHBondContact O-N 3.37Å; L8-L10 PolarHBondContact O-N 3.33Å
9	T	56.9	Low	53.4	Low	126 Å²	126	141.2 Å²	141.2	77%	0.773	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-53.3	130.5	172.6	41.9	0	0	0	0	111.6	L11	T9-L11 PolarHBondContact O-N 3.47Å
10	L	51.1	Low	53.7	Low	155 Å²	155	143 Å²	143	81%	0.812	80%	0.799	S	S	*	*			trans	-67.4	99.9	173	-163.8	74.9	0	0	0	108.8	L8 T12	L8-L10 PolarHBondContact O-N 3.33Å; L10-T12 HydrophobicContact CD2-CG2 3.74Å; L10-T12 HydrophobicContact CG-CG2 3.99Å; L10-T12 PolarHBondContact O-N 3.28Å
11	L	55.7	Low	54.2	Low	140 Å²	140	138.5 Å²	138.5	73%	0.733	78%	0.777	S	S	*	*			trans	-70.2	81.2	163.3	-80.2	156.7	0	0	0	108.1	T9 Q13	T9-L11 PolarHBondContact O-N 3.47Å; L11-Q13 HydrophobicContact CB-CG 4.49Å; L11-Q13 HydrophobicContact CD2-CG 4.46Å; L11-Q13 PolarHBondContact O-N 2.89Å
12	T	54.9	Low	55.5	Low	113 Å²	113	130.4 Å²	130.4	69%	0.693	75%	0.751	S	S	*	*			trans	-75.6	79.7	154.4	55.8	0	0	0	0	106.5	L10 G14	L10-T12 HydrophobicContact CD2-CG2 3.74Å; L10-T12 HydrophobicContact CG-CG2 3.99Å; L10-T12 PolarHBondContact O-N 3.28Å; T12-G14 PolarHBondContact O-N 3.39Å
13	Q	57.5	Low	57.8	Low	146 Å²	146	127.9 Å²	127.9	68%	0.682	72%	0.723	S	S	*	*			trans	-59	101.8	154.4	-65.8	178.9	34.9	0	0	104.6	L11 T15	L11-Q13 HydrophobicContact CB-CG 4.49Å; L11-Q13 HydrophobicContact CD2-CG 4.46Å; L11-Q13 PolarHBondContact O-N 2.89Å; Q13-T15 PolarHBondContact O-N 3.22Å
14	G	46.6	Very low	60.1	Low	75 Å²	75	120.8 Å²	120.8	77%	0.773	71%	0.706	S	S	*	*			trans	-61.6	88.6	162.8	0	0	0	0	0	106.1	T12 G16	T12-G14 PolarHBondContact O-N 3.39Å; G14-G16 PolarHBondContact O-N 3.15Å
15	T	53.5	Low	62.2	Low	122 Å²	122	119.3 Å²	119.3	75%	0.748	69%	0.686	S	S	*	*			trans	-56.8	98.3	155.9	47.4	0	0	0	0	104	Q13 S17	Q13-T15 PolarHBondContact O-N 3.22Å; T15-S17 PolarHBondContact O-N 2.74Å
16	G	50.5	Low	64.3	Low	52 Å²	52	113.6 Å²	113.6	54%	0.536	66%	0.658	S	S	.	*			trans	-47.2	115.7	171.8	0	0	0	0	0	106.2	G14 W18	G14-G16 PolarHBondContact O-N 3.15Å; G16-W18 PolarHBondContact O-N 2.65Å; G16-W18 PolarHBondContact O-NE1 3.26Å
17	S	54.3	Low	66.1	Low	112 Å²	112	113.1 Å²	113.1	78%	0.783	66%	0.664	S	S	*	*			trans	-66.6	112.5	179.8	-158.4	0	0	0	0	105.6	T15 A19	T15-S17 PolarHBondContact O-N 2.74Å; S17-A19 PolarHBondContact O-N 2.9Å
18	W	51.4	Low	67.9	Low	243 Å²	243	112.6 Å²	112.6	92%	0.92	66%	0.655	S	S	*	*			trans	-71.2	71.9	174.3	-60.3	67.3	0	0	0	106.6	G16 Q20	G16-W18 PolarHBondContact O-N 2.65Å; G16-W18 PolarHBondContact O-NE1 3.26Å; W18-Q20 PolarHBondContact O-N 3.4Å
19	A	57.8	Low	69.8	Low	85 Å²	85	107.4 Å²	107.4	70%	0.702	63%	0.63	S	S	*	*			trans	-70.8	100.3	-179.8	0	0	0	0	0	107.3	S17 S21	S17-A19 PolarHBondContact O-N 2.9Å; A19-S21 PolarHBondContact O-N 3.27Å
20	Q	59.3	Low	71.7	Confident	177 Å²	177	105.6 Å²	105.6	83%	0.827	62%	0.623	S	S	*	*			trans	-53.4	133.2	161.4	-174.4	165.3	-56.5	0	0	107.6	W18 A22	W18-Q20 PolarHBondContact O-N 3.4Å; Q20-A22 PolarHBondContact O-N 3.36Å; Q20-A22 VanDerWaalsContact O-N 3.14Å
21	S	64.6	Low	73.9	Confident	49 Å²	49	99.9 Å²	99.9	34%	0.343	60%	0.601	S	S	.	*			trans	-54.8	125	-174.7	-164.9	0	0	0	0	110.8	A19 L23 D47	A19-S21 PolarHBondContact O-N 3.27Å; S21-L23 PolarHBondContact O-N 3.1Å; S21-D47 WeakPolarHBondContact CB-OD2 3.27Å; S21-D47 PolarHBondContact OG-OD2 2.81Å
22	A	81.1	Confident	75.9	Confident	83 Å²	83	95.5 Å²	95.5	69%	0.686	59%	0.585	S	S	*	*			trans	-86.7	99.1	-176.7	0	0	0	0	0	109.5	Q20	Q20-A22 PolarHBondContact O-N 3.36Å; Q20-A22 VanDerWaalsContact O-N 3.14Å
23	L	92.4	Very high	77.9	Confident	45 Å²	45	95.8 Å²	95.8	24%	0.236	59%	0.589	C	S	.	*			trans	-68.6	133.4	172.4	-60.8	174.3	0	0	0	109.9	S21 V48 L111	S21-L23 PolarHBondContact O-N 3.1Å; L23-V48 HydrophobicContact CD2-CG2 3.68Å; L23-L111 HydrophobicContact CD1-CG 4.09Å; L23-L111 HydrophobicContact CD2-CD1 3.88Å; L23-L111 HydrophobicContact CD2-CG 4.14Å
24	T	95.9	Very high	79.7	Confident	91 Å²	91	91.5 Å²	91.5	56%	0.558	58%	0.584	S	S	*	*	B	Isolated β-bridge	trans	-104.6	127.5	177.6	-58.1	0	0	0	0	110.2	C41 T42	T24-C41 WeakPolarHBondContact O-CA 3.47Å; T24-T42 PolarHBondContact N-O 3.29Å; T24-T42 PolarHBondContact O-N 3.03Å
25	Q	97.4	Very high	82.2	Confident	48 Å²	48	93.1 Å²	93.1	22%	0.224	57%	0.572	C	S	.	*			trans	-125.7	151.9	174.7	-70	-175.5	-121.6	0	0	110.3	C41 Y107 C109	Q25-C41 HydrophobicContact CG-CB 4.35Å; Q25-Y107 PolarHBondContact NE2-O 2.84Å; Q25-C109 PolarHBondContact OE1-SG 2.77Å
26	P	97.7	Very high	84.3	Confident	42 Å²	42	90.9 Å²	90.9	27%	0.273	56%	0.561	S	S	.	*			trans	-62.3	143.1	170	27.7	-33.5	0	0	0	109.9	F28 V29 I39 S40	P26-F28 PolarHBondContact O-N 3.25Å; P26-V29 HydrophobicContact CB-CG2 4.22Å; P26-V29 HydrophobicContact CG-CG2 3.76Å; P26-I39 HydrophobicContact CG-CG2 4.17Å; P26-S40 VanDerWaalsContact CD-O 3.26Å; P26-S40 WeakPolarHBondContact CD-O 3.46Å
27	P	95.6	Very high	86.6	Confident	141 Å²	141	89.3 Å²	89.3	92%	0.916	54%	0.541	S	S	*	.	S	Bend	trans	-68.2	-27.2	-179.1	27.6	-34.9	0	0	0	112.5
28	F	95.7	Very high	88.7	Confident	157 Å²	157	87.5 Å²	87.5	69%	0.689	53%	0.525	S	S	*	.			trans	-156.9	149	-179.7	-178.2	-105.4	0	0	0	111	P26 S30	P26-F28 PolarHBondContact O-N 3.25Å; F28-S30 VanDerWaalsContact CE1-CB 3.47Å
29	V	96.9	Very high	90.9	Very high	54 Å²	54	76.6 Å²	76.6	33%	0.327	48%	0.484	S	S	.	.			trans	-139.6	138.4	171.9	-176.6	0	0	0	0	108	P26 V37 I39	P26-V29 HydrophobicContact CB-CG2 4.22Å; P26-V29 HydrophobicContact CG-CG2 3.76Å; V29-V37 HydrophobicContact CG1-CB 3.8Å; V29-V37 HydrophobicContact CG1-CG1 4.05Å; V29-V37 HydrophobicContact CG1-CG2 4.41Å; V29-I39 HydrophobicContact CG2-CG1 4.33Å
30	S	96.7	Very high	92.8	Very high	88 Å²	88	74.4 Å²	74.4	62%	0.615	46%	0.464	S	S	*	.			trans	-134.3	162.7	175.3	56	0	0	0	0	111.9	F28 V37	F28-S30 VanDerWaalsContact CE1-CB 3.47Å; S30-V37 WeakPolarHBondContact O-CG1 3.4Å
31	G	96.4	Very high	94.7	Very high	35 Å²	35	66 Å²	66	36%	0.361	43%	0.425	S	S	.	.			trans	-162.8	165.1	173.2	0	0	0	0	0	110.7
32	A	96.9	Very high	96.2	Very high	47 Å²	47	65.5 Å²	65.5	39%	0.388	42%	0.42	S	S	.	.			trans	-76.9	157.7	176.8	0	0	0	0	0	111.5	G34 Q35	A32-G34 PolarHBondContact O-N 3.14Å; A32-Q35 HydrophobicContact CB-CG 4.12Å; A32-Q35 VanDerWaalsContact O-CB 3.32Å; A32-Q35 WeakPolarHBondContact O-CB 3.41Å; A32-Q35 PolarHBondContact O-N 3.45Å
33	P	97	Very high	96.7	Very high	119 Å²	119	62.1 Å²	62.1	77%	0.773	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.1	134.9	173.9	-27.2	35.5	0	0	0	112.3	Q35 L99	P33-Q35 PolarHBondContact O-N 3.1Å; P33-L99 WeakPolarHBondContact CA-O 3.26Å
34	G	96.6	Very high	96.7	Very high	57 Å²	57	62.9 Å²	62.9	59%	0.588	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.9	-13.8	-177.6	0	0	0	0	0	115.6	A32 L99	A32-G34 PolarHBondContact O-N 3.14Å; G34-L99 PolarHBondContact N-O 2.83Å
35	Q	97.9	Very high	96.4	Very high	109 Å²	109	62.5 Å²	62.5	51%	0.509	40%	0.4	S	S	.	.			trans	-73.1	168.7	173.5	-67.9	-170.7	-40.3	0	0	111.9	A32 P33 G98 L99	A32-Q35 HydrophobicContact CB-CG 4.12Å; A32-Q35 VanDerWaalsContact O-CB 3.32Å; A32-Q35 WeakPolarHBondContact O-CB 3.41Å; A32-Q35 PolarHBondContact O-N 3.45Å; P33-Q35 PolarHBondContact O-N 3.1Å; Q35-G98 PolarHBondContact O-N 2.5Å; Q35-G98 VanDerWaalsContact O-N 3.14Å; Q35-L99 WeakPolarHBondContact O-CG 3.48Å; Q35-L99 PolarHBondContact O-N 2.96Å
36	S	97.9	Very high	96	Very high	74 Å²	74	63.7 Å²	63.7	52%	0.517	41%	0.414	S	S	.	.			trans	-107.3	143.8	169.2	-55.4	0	0	0	0	110.1	I96 S97	S36-I96 CarbonylContact C-O 3.58Å; S36-I96 VanDerWaalsContact CA-O 3.23Å; S36-I96 WeakPolarHBondContact CA-O 3.35Å; S36-S97 WeakPolarHBondContact OG-CA 3.48Å
37	V	98.3	Very high	95.5	Very high	20 Å²	20	62.4 Å²	62.4	12%	0.121	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	154	172.6	-68.2	0	0	0	0	110.1	V29 S30 T95 I96 L99	V29-V37 HydrophobicContact CG1-CB 3.8Å; V29-V37 HydrophobicContact CG1-CG1 4.05Å; V29-V37 HydrophobicContact CG1-CG2 4.41Å; S30-V37 WeakPolarHBondContact O-CG1 3.4Å; V37-T95 WeakPolarHBondContact O-CA 3.44Å; V37-I96 HydrophobicContact CG2-CB 4.07Å; V37-I96 PolarHBondContact N-O 2.98Å; V37-I96 PolarHBondContact O-N 3.27Å; V37-L99 HydrophobicContact CG1-CD1 3.66Å; V37-L99 HydrophobicContact CG2-CD1 4.15Å; V37-L99 HydrophobicContact CG2-CD2 3.86Å; V37-L99 HydrophobicContact CG2-CG 4.28Å
38	T	98.4	Very high	95.4	Very high	73 Å²	73	55.7 Å²	55.7	45%	0.448	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	128.8	177.1	-62	0	0	0	0	109.7	L94 T95	T38-L94 CarbonylContact C-O 3.53Å; T38-L94 WeakPolarHBondContact CA-O 3.27Å; T38-T95 PolarHBondContact OG1-OG1 3.47Å; T38-T95 VanDerWaalsContact OG1-OG1 3.06Å
39	I	98.6	Very high	95.2	Very high	14 Å²	14	49.2 Å²	49.2	7%	0.072	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	121.8	173.9	-51.1	178.7	0	0	0	107.1	P26 V29 W56 S93 L94 I96 Y107	P26-I39 HydrophobicContact CG-CG2 4.17Å; V29-I39 HydrophobicContact CG2-CG1 4.33Å; I39-W56 HydrophobicContact CB-CH2 4.13Å; I39-W56 HydrophobicContact CB-CZ3 4.16Å; I39-W56 HydrophobicContact CG2-CH2 3.92Å; I39-W56 HydrophobicContact CG2-CZ3 3.82Å; I39-W56 VanDerWaalsContact O-CH2 3.27Å; I39-W56 WeakPolarHBondContact O-CH2 3.39Å; I39-S93 CarbonylContact O-C 3.58Å; I39-S93 WeakPolarHBondContact O-CA 3.49Å; I39-L94 HydrophobicContact CD1-CD2 4.45Å; I39-L94 PolarHBondContact N-O 3.31Å; I39-L94 PolarHBondContact O-N 3.05Å; I39-I96 HydrophobicContact CD1-CD1 4.14Å; I39-Y107 HydrophobicContact CD1-CD1 4.46Å; I39-Y107 HydrophobicContact CD1-CD2 3.65Å; I39-Y107 HydrophobicContact CD1-CE2 4.45Å; I39-Y107 HydrophobicContact CD1-CG 3.65Å
40	S	98.3	Very high	94.9	Very high	40 Å²	40	52 Å²	52	28%	0.28	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	150.9	176.8	54.3	0	0	0	0	111.7	P26 A92	P26-S40 VanDerWaalsContact CD-O 3.26Å; P26-S40 WeakPolarHBondContact CD-O 3.46Å; S40-A92 WeakPolarHBondContact CA-O 3.49Å
41	C	97.4	Very high	94.5	Very high	0 Å²	0	53.2 Å²	53.2	0%	0	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	108.8	171.2	176.1	0	0	0	0	108.3	T24 Q25 W56 A92 C109	T24-C41 WeakPolarHBondContact O-CA 3.47Å; Q25-C41 HydrophobicContact CG-CB 4.35Å; C41-W56 HydrophobicContact CB-CH2 3.7Å; C41-W56 HydrophobicContact CB-CZ2 3.7Å; C41-A92 HydrophobicContact CB-CB 4.33Å; C41-A92 PolarHBondContact N-O 2.91Å; C41-A92 PolarHBondContact O-N 2.92Å; C41-C109 HydrophobicContact CB-CB 3.49Å; C41-C109 VanDerWaalsContact CB-CB 3.49Å; C41-C109 WeakPolarHBondContact CB-SG 3.21Å; C41-C109 WeakPolarHBondContact SG-CB 3.34Å; C41-C109 CovalentContact SG-SG 2.02Å; C41-C109 PolarHBondContact SG-SG 2.93Å
42	T	96.5	Very high	94.3	Very high	39 Å²	39	56.1 Å²	56.1	24%	0.239	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	128.8	-175.6	-51.7	0	0	0	0	110.1	T24	T24-T42 PolarHBondContact N-O 3.29Å; T24-T42 PolarHBondContact O-N 3.03Å
43	G	93.1	Very high	94	Very high	11 Å²	11	57.4 Å²	57.4	11%	0.113	35%	0.349	C	S	.	.			trans	-117.5	-160.6	170.2	0	0	0	0	0	112.1	D47 N90	G43-D47 WeakPolarHBondContact CA-OD1 3.39Å; G43-N90 PolarHBondContact N-O 3.12Å; G43-N90 PolarHBondContact O-ND2 2.88Å
44	T	91.6	Very high	94	Very high	61 Å²	61	51.8 Å²	51.8	37%	0.374	31%	0.312	S	S	.	.			trans	-83.8	177.4	166.2	73.1	0	0	0	0	112.3	S46 D47 G49 N90	T44-S46 VanDerWaalsContact C-N 3.32Å; T44-S46 PolarHBondContact OG1-N 3.06Å; T44-S46 PolarHBondContact OG1-OG 3.13Å; T44-D47 VanDerWaalsContact CA-OD1 3.22Å; T44-D47 WeakPolarHBondContact CA-OD1 3.14Å; T44-D47 PolarHBondContact N-OD1 2.96Å; T44-D47 VanDerWaalsContact OG1-CG 3.32Å; T44-D47 PolarHBondContact OG1-N 2.72Å; T44-D47 PolarHBondContact OG1-OD1 2.8Å; T44-G49 PolarHBondContact O-N 2.58Å; T44-N90 WeakPolarHBondContact O-CB 3.19Å
45	S	90.1	Very high	94	Very high	83 Å²	83	50.7 Å²	50.7	58%	0.58	29%	0.291	S	S	*	.	I	π-helix	trans	-65.7	-38.2	169.8	54.6	0	0	0	0	111.5	D47 G49 D50	S45-D47 VanDerWaalsContact C-N 3.27Å; S45-D47 PolarHBondContact O-N 2.95Å; S45-G49 CarbonylContact O-C 3.4Å; S45-G49 WeakPolarHBondContact O-CA 3.42Å; S45-G49 PolarHBondContact O-N 3.25Å; S45-D50 PolarHBondContact O-N 3.06Å
46	S	88.3	Confident	94	Very high	73 Å²	73	45.5 Å²	45.5	51%	0.51	27%	0.267	S	S	.	.	I	π-helix	trans	-79.1	-1.1	-173.6	62.8	0	0	0	0	114.9	T44 D50 Y51	T44-S46 VanDerWaalsContact C-N 3.32Å; T44-S46 PolarHBondContact OG1-N 3.06Å; T44-S46 PolarHBondContact OG1-OG 3.13Å; S46-D50 WeakPolarHBondContact CA-OD2 3.42Å; S46-Y51 WeakPolarHBondContact O-CE2 3.32Å
47	D	88.4	Confident	93.9	Very high	15 Å²	15	45.3 Å²	45.3	8%	0.08	26%	0.256	C	S	.	.	I	π-helix	trans	-122.6	-74	-177.1	74	-19.4	0	0	0	112.5	S21 G43 T44 S45 Y51 L111	S21-D47 WeakPolarHBondContact CB-OD2 3.27Å; S21-D47 PolarHBondContact OG-OD2 2.81Å; G43-D47 WeakPolarHBondContact CA-OD1 3.39Å; T44-D47 VanDerWaalsContact CA-OD1 3.22Å; T44-D47 WeakPolarHBondContact CA-OD1 3.14Å; T44-D47 PolarHBondContact N-OD1 2.96Å; T44-D47 VanDerWaalsContact OG1-CG 3.32Å; T44-D47 PolarHBondContact OG1-N 2.72Å; T44-D47 PolarHBondContact OG1-OD1 2.8Å; S45-D47 VanDerWaalsContact C-N 3.27Å; S45-D47 PolarHBondContact O-N 2.95Å; D47-Y51 WeakPolarHBondContact O-CD2 3.45Å; D47-L111 HydrophobicContact CB-CD1 3.48Å; D47-L111 VanDerWaalsContact CB-CD1 3.48Å
48	V	91.9	Very high	93.9	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	25%	0.252	C	S	.	.	I	π-helix	trans	-74	-39.2	174.8	178	0	0	0	0	109.3	L23 V54 K87 N90 A92 L111	L23-V48 HydrophobicContact CD2-CG2 3.68Å; V48-V54 HydrophobicContact CG1-CG2 4.14Å; V48-K87 HydrophobicContact CG1-CD 3.88Å; V48-K87 HydrophobicContact CG1-CG 4.26Å; V48-K87 WeakPolarHBondContact O-CD 3.2Å; V48-K87 PolarHBondContact O-NZ 3.28Å; V48-N90 VanDerWaalsContact CG1-C 3.42Å; V48-N90 WeakPolarHBondContact CG1-O 3.41Å; V48-A92 HydrophobicContact CG1-CB 4.22Å; V48-L111 HydrophobicContact CG2-CD1 4.14Å; V48-L111 HydrophobicContact CG2-CD2 4.02Å; V48-L111 HydrophobicContact CG2-CG 4.48Å
49	G	91.6	Very high	93.6	Very high	21 Å²	21	46.6 Å²	46.6	22%	0.216	25%	0.253	C	S	.	.	I	π-helix	trans	-61.2	-58.8	-176.7	0	0	0	0	0	113	T44 S45 K87 G89	T44-G49 PolarHBondContact O-N 2.58Å; S45-G49 CarbonylContact O-C 3.4Å; S45-G49 WeakPolarHBondContact O-CA 3.42Å; S45-G49 PolarHBondContact O-N 3.25Å; G49-K87 PolarHBondContact O-NZ 2.97Å; G49-G89 WeakPolarHBondContact CA-O 3.23Å
50	D	91.2	Very high	93.2	Very high	114 Å²	114	50.6 Å²	50.6	61%	0.61	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.8	-20.8	-170.1	-71.3	-13.7	0	0	0	113.8	S45 S46	S45-D50 PolarHBondContact O-N 3.06Å; S46-D50 WeakPolarHBondContact CA-OD2 3.42Å
51	Y	88.1	Confident	92.5	Very high	112 Å²	112	56.1 Å²	56.1	44%	0.439	29%	0.293	S	S	.	.			trans	-120.2	146.9	-175.6	-56.2	-76.5	0	0	0	112.8	S46 D47 H53 K87	S46-Y51 WeakPolarHBondContact O-CE2 3.32Å; D47-Y51 WeakPolarHBondContact O-CD2 3.45Å; Y51-H53 VanDerWaalsContact C-N 3.29Å; Y51-H53 PolarHBondContact O-N 2.8Å; Y51-K87 PolarHBondContact O-NZ 2.86Å
52	D	91.7	Very high	91.5	Very high	97 Å²	97	62.6 Å²	62.6	52%	0.519	34%	0.339	S	S	.	.			trans	-97.7	37.8	173.1	-69.1	-26.3	0	0	0	111.5	N71 V72 K87	D52-N71 CarbonylContact O-C 3.58Å; D52-N71 WeakPolarHBondContact O-CA 3.36Å; D52-V72 HydrophobicContact CB-CG2 4.06Å; D52-K87 WeakPolarHBondContact OD1-CE 3.07Å; D52-K87 IonicContact OD1-NZ 2.68Å; D52-K87 PolarHBondContact OD1-NZ 3.3Å
53	H	92.2	Very high	90.7	Very high	74 Å²	74	64 Å²	64	34%	0.343	35%	0.347	S	S	.	.			trans	-112.4	47.3	-176.7	-61.9	-50	0	0	0	112.6	Y51 F55 N71 L111 Y112	Y51-H53 VanDerWaalsContact C-N 3.29Å; Y51-H53 PolarHBondContact O-N 2.8Å; H53-F55 HydrophobicContact CB-CE2 4.16Å; H53-F55 VanDerWaalsContact O-CD2 3.27Å; H53-F55 WeakPolarHBondContact O-CD2 3.1Å; H53-F55 WeakPolarHBondContact O-CE2 3.18Å; H53-N71 PolarHBondContact ND1-OD1 2.88Å; H53-L111 WeakPolarHBondContact O-CA 3.21Å; H53-Y112 PolarHBondContact O-N 2.95Å; H53-Y112 VanDerWaalsContact O-N 3.13Å
54	V	95.3	Very high	90.4	Very high	0 Å²	0	69.7 Å²	69.7	0%	0	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	132.6	172.3	-173.9	0	0	0	0	109.9	V48 N71 V72 A92 C109 S110 L111	V48-V54 HydrophobicContact CG1-CG2 4.14Å; V54-N71 PolarHBondContact O-N 2.96Å; V54-V72 HydrophobicContact CB-CG2 4.14Å; V54-V72 HydrophobicContact CG2-CG2 4.16Å; V54-V72 PolarHBondContact O-N 2.84Å; V54-A92 HydrophobicContact CB-CB 4.2Å; V54-A92 HydrophobicContact CG1-CB 3.71Å; V54-A92 HydrophobicContact CG2-CB 3.96Å; V54-C109 HydrophobicContact CG1-CB 4.48Å; V54-S110 WeakPolarHBondContact CA-O 3.45Å; V54-L111 HydrophobicContact CB-CD2 4.38Å; V54-L111 HydrophobicContact CG2-CD2 3.64Å
55	F	97.3	Very high	90.3	Very high	34 Å²	34	70 Å²	70	15%	0.149	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	144.4	178.4	-57.8	-102.5	0	0	0	109.6	H53 Y57 L67 I69 C109 S110	H53-F55 HydrophobicContact CB-CE2 4.16Å; H53-F55 VanDerWaalsContact O-CD2 3.27Å; H53-F55 WeakPolarHBondContact O-CD2 3.1Å; H53-F55 WeakPolarHBondContact O-CE2 3.18Å; F55-Y57 HydrophobicContact CB-CD2 4.4Å; F55-Y57 HydrophobicContact CB-CE2 3.56Å; F55-L67 HydrophobicContact CB-CD1 4.16Å; F55-L67 HydrophobicContact CD1-CD1 4.03Å; F55-I69 CarbonylContact C-O 3.6Å; F55-I69 VanDerWaalsContact CA-O 3.3Å; F55-I69 WeakPolarHBondContact CA-O 3.36Å; F55-C109 CarbonylContact O-C 3.53Å; F55-C109 WeakPolarHBondContact O-CA 3.29Å; F55-S110 PolarHBondContact N-O 2.96Å; F55-S110 PolarHBondContact O-N 2.83Å
56	W	98.1	Very high	90.6	Very high	0 Å²	0	71.5 Å²	71.5	0%	0	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	130.5	174.5	-72.7	96.8	0	0	0	110.7	I39 C41 L68 I69 L94 C109	I39-W56 HydrophobicContact CB-CH2 4.13Å; I39-W56 HydrophobicContact CB-CZ3 4.16Å; I39-W56 HydrophobicContact CG2-CH2 3.92Å; I39-W56 HydrophobicContact CG2-CZ3 3.82Å; I39-W56 VanDerWaalsContact O-CH2 3.27Å; I39-W56 WeakPolarHBondContact O-CH2 3.39Å; C41-W56 HydrophobicContact CB-CH2 3.7Å; C41-W56 HydrophobicContact CB-CZ2 3.7Å; W56-L68 HydrophobicContact CB-CB 4.44Å; W56-L68 PolarHBondContact O-N 3.03Å; W56-I69 HydrophobicContact CB-CB 4.12Å; W56-I69 HydrophobicContact CG-CB 4.46Å; W56-I69 PolarHBondContact N-O 2.81Å; W56-I69 PolarHBondContact O-N 3.01Å; W56-L94 HydrophobicContact CB-CD1 4.3Å; W56-L94 HydrophobicContact CB-CD2 4.33Å; W56-L94 HydrophobicContact CD2-CB 3.48Å; W56-L94 VanDerWaalsContact CD2-CB 3.48Å; W56-L94 HydrophobicContact CD2-CD2 4.08Å; W56-L94 HydrophobicContact CD2-CG 4.24Å; W56-L94 HydrophobicContact CE3-CB 3.69Å; W56-L94 HydrophobicContact CE3-CD2 3.78Å; W56-L94 HydrophobicContact CE3-CG 4.34Å; W56-L94 HydrophobicContact CG-CB 3.98Å; W56-L94 HydrophobicContact CG-CD1 4.19Å; W56-L94 HydrophobicContact CG-CD2 4.32Å; W56-L94 HydrophobicContact CG-CG 4.41Å; W56-L94 HydrophobicContact CH2-CB 3.95Å; W56-L94 HydrophobicContact CZ2-CB 3.76Å; W56-L94 HydrophobicContact CZ3-CB 3.92Å; W56-L94 HydrophobicContact CZ3-CD2 4.38Å; W56-C109 HydrophobicContact CD2-CB 4.14Å; W56-C109 HydrophobicContact CE3-CB 4.01Å; W56-C109 HydrophobicContact CH2-CB 4.04Å; W56-C109 HydrophobicContact CZ2-CB 4.16Å; W56-C109 HydrophobicContact CZ3-CB 3.96Å
57	Y	96.7	Very high	91	Very high	71 Å²	71	70.6 Å²	70.6	28%	0.278	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	144.3	178.7	-61	-91.6	0	0	0	111.3	F55 R66 L67 Y107 H108 S110	F55-Y57 HydrophobicContact CB-CD2 4.4Å; F55-Y57 HydrophobicContact CB-CE2 3.56Å; Y57-R66 CarbonylContact C-O 3.53Å; Y57-R66 VanDerWaalsContact CA-O 3.27Å; Y57-R66 WeakPolarHBondContact CA-O 3.47Å; Y57-L67 HydrophobicContact CD1-CB 4.2Å; Y57-L67 HydrophobicContact CD1-CD1 4.19Å; Y57-L67 HydrophobicContact CE1-CB 4Å; Y57-L67 HydrophobicContact CE1-CD1 3.7Å; Y57-L67 HydrophobicContact CE1-CG 4.44Å; Y57-L67 HydrophobicContact CE2-CD1 4.35Å; Y57-Y107 WeakPolarHBondContact O-CA 3.35Å; Y57-H108 PolarHBondContact N-O 2.83Å; Y57-H108 PolarHBondContact O-N 3.32Å; Y57-S110 WeakPolarHBondContact CE2-OG 3.14Å
58	Q	96.4	Very high	91.4	Very high	7 Å²	7	69.9 Å²	69.9	3%	0.033	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	133.9	168.2	-169.9	-179.2	44	0	0	109.7	S65 R66 L68 A105 N106 Y107	Q58-S65 WeakPolarHBondContact O-CA 3.39Å; Q58-R66 PolarHBondContact N-O 2.81Å; Q58-R66 PolarHBondContact O-N 2.88Å; Q58-L68 HydrophobicContact CB-CD1 3.87Å; Q58-L68 HydrophobicContact CB-CD2 3.89Å; Q58-L68 HydrophobicContact CB-CG 3.95Å; Q58-A105 HydrophobicContact CG-CB 3.49Å; Q58-A105 VanDerWaalsContact CG-CB 3.49Å; Q58-N106 CarbonylContact C-O 3.6Å; Q58-Y107 HydrophobicContact CB-CD1 4.34Å; Q58-Y107 HydrophobicContact CB-CE1 4.07Å; Q58-Y107 HydrophobicContact CG-CD1 4.37Å; Q58-Y107 HydrophobicContact CG-CE1 3.8Å; Q58-Y107 PolarHBondContact NE2-OH 3.32Å
59	K	92.8	Very high	91.7	Very high	112 Å²	112	69.9 Å²	69.9	49%	0.487	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	115.3	171.3	-173.1	174.5	-177.2	177.3	0	109.9	N106	K59-N106 HydrophobicContact CB-CB 4.43Å; K59-N106 PolarHBondContact N-O 3.46Å; K59-N106 PolarHBondContact O-N 2.77Å
60	R	89.8	Confident	92	Very high	99 Å²	99	72.9 Å²	72.9	37%	0.374	37%	0.368	S	S	.	.			trans	-93.3	158.6	167.6	-62.9	-179.5	-179	146.1	-1.2	109.5	S62 T63 E102 A105	R60-S62 PolarHBondContact O-N 2.88Å; R60-T63 VanDerWaalsContact C-OG1 3.29Å; R60-T63 WeakPolarHBondContact CA-OG1 3.37Å; R60-T63 HydrophobicContact CB-CG2 4.1Å; R60-T63 WeakPolarHBondContact CB-OG1 3.31Å; R60-T63 PolarHBondContact N-OG1 3.04Å; R60-T63 PolarHBondContact O-N 2.8Å; R60-T63 VanDerWaalsContact O-N 3.12Å; R60-T63 PolarHBondContact O-OG1 2.84Å; R60-E102 PolarHBondContact NE-O 3.32Å; R60-E102 PolarHBondContact NH2-O 2.75Å; R60-A105 HydrophobicContact CG-CB 3.95Å
61	L	84	Confident	92.2	Very high	156 Å²	156	70.4 Å²	70.4	82%	0.817	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.8	132.6	177.3	-64.9	174.3	0	0	0	110.4	T63	L61-T63 PolarHBondContact O-N 3.25Å; L61-T63 VanDerWaalsContact O-N 3.13Å
62	S	77.2	Confident	92.7	Very high	136 Å²	136	65.6 Å²	65.6	95%	0.951	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.5	18.9	179.3	-51.1	0	0	0	0	116.1	R60	R60-S62 PolarHBondContact O-N 2.88Å
63	T	79.2	Confident	93	Very high	69 Å²	69	66.1 Å²	66.1	42%	0.423	34%	0.34	S	S	.	.	S	Bend	trans	-114	152.2	177.2	63.7	0	0	0	0	112.7	R60 L61	R60-T63 VanDerWaalsContact C-OG1 3.29Å; R60-T63 WeakPolarHBondContact CA-OG1 3.37Å; R60-T63 HydrophobicContact CB-CG2 4.1Å; R60-T63 WeakPolarHBondContact CB-OG1 3.31Å; R60-T63 PolarHBondContact N-OG1 3.04Å; R60-T63 PolarHBondContact O-N 2.8Å; R60-T63 VanDerWaalsContact O-N 3.12Å; R60-T63 PolarHBondContact O-OG1 2.84Å; L61-T63 PolarHBondContact O-N 3.25Å; L61-T63 VanDerWaalsContact O-N 3.13Å
64	T	86.4	Confident	93.2	Very high	130 Å²	130	64.9 Å²	64.9	80%	0.798	34%	0.337	S	S	*	.	P	Polyproline II helix	trans	-63.8	138.4	166.7	-52.5	0	0	0	0	109.8	R66	T64-R66 PolarHBondContact O-N 3.45Å
65	S	90.8	Very high	93.4	Very high	66 Å²	66	69.7 Å²	69.7	46%	0.462	36%	0.356	S	S	.	.	P	Polyproline II helix	trans	-53.9	127.5	173.6	-61.8	0	0	0	0	110.6	Q58	Q58-S65 WeakPolarHBondContact O-CA 3.39Å
66	R	94.5	Very high	93.4	Very high	116 Å²	116	69.5 Å²	69.5	44%	0.438	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	127.8	179	-174.3	-179.2	-172.6	-172.5	2.2	109.9	Y57 Q58 T64 G78 I79	Y57-R66 CarbonylContact C-O 3.53Å; Y57-R66 VanDerWaalsContact CA-O 3.27Å; Y57-R66 WeakPolarHBondContact CA-O 3.47Å; Q58-R66 PolarHBondContact N-O 2.81Å; Q58-R66 PolarHBondContact O-N 2.88Å; T64-R66 PolarHBondContact O-N 3.45Å; R66-G78 PolarHBondContact NH2-O 2.99Å; R66-I79 HydrophobicContact CG-CD1 4.19Å
67	L	96.6	Very high	93.4	Very high	54 Å²	54	75.7 Å²	75.7	28%	0.283	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	126.7	172.8	-179.6	66.8	0	0	0	110.2	F55 Y57 I69 Y70 P76 I79	F55-L67 HydrophobicContact CB-CD1 4.16Å; F55-L67 HydrophobicContact CD1-CD1 4.03Å; Y57-L67 HydrophobicContact CD1-CB 4.2Å; Y57-L67 HydrophobicContact CD1-CD1 4.19Å; Y57-L67 HydrophobicContact CE1-CB 4Å; Y57-L67 HydrophobicContact CE1-CD1 3.7Å; Y57-L67 HydrophobicContact CE1-CG 4.44Å; Y57-L67 HydrophobicContact CE2-CD1 4.35Å; L67-I69 WeakPolarHBondContact CD1-O 3.39Å; L67-Y70 HydrophobicContact CD2-CD1 4.47Å; L67-P76 HydrophobicContact CD2-CG 3.92Å; L67-P76 HydrophobicContact CG-CG 4.02Å; L67-I79 WeakPolarHBondContact O-CD1 3.2Å
68	L	98.1	Very high	93.3	Very high	0 Å²	0	75.6 Å²	75.6	0%	0	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	-46.6	178.4	-58.4	179.7	0	0	0	112.4	W56 Q58 P76 I79 F83 L94 Y107	W56-L68 HydrophobicContact CB-CB 4.44Å; W56-L68 PolarHBondContact O-N 3.03Å; Q58-L68 HydrophobicContact CB-CD1 3.87Å; Q58-L68 HydrophobicContact CB-CD2 3.89Å; Q58-L68 HydrophobicContact CB-CG 3.95Å; L68-P76 WeakPolarHBondContact O-CD 3.34Å; L68-I79 HydrophobicContact CD2-CD1 4.42Å; L68-I79 HydrophobicContact CD2-CG2 4.27Å; L68-F83 HydrophobicContact CD1-CD1 3.84Å; L68-F83 HydrophobicContact CD1-CE1 3.96Å; L68-F83 HydrophobicContact CD1-CG 4.37Å; L68-F83 HydrophobicContact CD2-CD2 4.39Å; L68-F83 HydrophobicContact CD2-CE2 4.34Å; L68-F83 HydrophobicContact CD2-CZ 4.44Å; L68-L94 HydrophobicContact CD1-CD2 4.01Å; L68-Y107 HydrophobicContact CD1-CD1 3.75Å; L68-Y107 HydrophobicContact CD1-CE1 3.59Å
69	I	98.5	Very high	93.3	Very high	0 Å²	0	76.1 Å²	76.1	0%	0	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	137.7	-177.3	-56	-67.8	0	0	0	108	F55 W56 L67 V72 T74 R75 L94	F55-I69 CarbonylContact C-O 3.6Å; F55-I69 VanDerWaalsContact CA-O 3.3Å; F55-I69 WeakPolarHBondContact CA-O 3.36Å; W56-I69 HydrophobicContact CB-CB 4.12Å; W56-I69 HydrophobicContact CG-CB 4.46Å; W56-I69 PolarHBondContact N-O 2.81Å; W56-I69 PolarHBondContact O-N 3.01Å; L67-I69 WeakPolarHBondContact CD1-O 3.39Å; I69-V72 VanDerWaalsContact CG2-O 3.31Å; I69-V72 WeakPolarHBondContact CG2-O 3.46Å; I69-T74 CarbonylContact C-O 3.52Å; I69-T74 VanDerWaalsContact CA-O 3.31Å; I69-T74 WeakPolarHBondContact CA-O 3.31Å; I69-R75 HydrophobicContact CD1-CB 3.95Å; I69-R75 HydrophobicContact CD1-CG 4.38Å; I69-L94 HydrophobicContact CG1-CD1 3.87Å
70	Y	96.9	Very high	93.5	Very high	83 Å²	83	73.1 Å²	73.1	33%	0.325	42%	0.417	S	S	.	.	B	Isolated β-bridge	trans	-126.8	163	168.7	68.3	-82.3	0	0	0	109.9	L67 V72 T74 P76	L67-Y70 HydrophobicContact CD2-CD1 4.47Å; Y70-V72 VanDerWaalsContact C-N 3.26Å; Y70-V72 PolarHBondContact O-N 3.38Å; Y70-T74 HydrophobicContact CD1-CG2 4.33Å; Y70-T74 WeakPolarHBondContact CD1-O 3.2Å; Y70-T74 HydrophobicContact CE1-CG2 3.55Å; Y70-T74 HydrophobicContact CE2-CG2 3.76Å; Y70-T74 PolarHBondContact N-O 3.44Å; Y70-T74 WeakPolarHBondContact O-CA 3.45Å; Y70-T74 VanDerWaalsContact O-CB 3.29Å; Y70-T74 WeakPolarHBondContact O-CB 3.14Å; Y70-T74 PolarHBondContact O-N 2.9Å; Y70-T74 WeakPolarHBondContact OH-CG2 3.3Å; Y70-P76 HydrophobicContact CD1-CG 3.79Å; Y70-P76 HydrophobicContact CE1-CG 3.99Å
71	N	96.4	Very high	93.8	Very high	62 Å²	62	74.1 Å²	74.1	33%	0.332	43%	0.43	S	S	.	.	T	Hydrogen-bonded Turn	trans	46	50.5	-176.7	-66.1	-14.7	0	0	0	112.8	D52 H53 V54 N73	D52-N71 CarbonylContact O-C 3.58Å; D52-N71 WeakPolarHBondContact O-CA 3.36Å; H53-N71 PolarHBondContact ND1-OD1 2.88Å; V54-N71 PolarHBondContact O-N 2.96Å; N71-N73 PolarHBondContact O-N 3.46Å; N71-N73 PolarHBondContact O-OD1 2.87Å
72	V	97.1	Very high	94.4	Very high	11 Å²	11	68.3 Å²	68.3	7%	0.067	40%	0.4	C	S	.	.	T	Hydrogen-bonded Turn	trans	69.6	-47	178.4	176.2	0	0	0	0	115.6	D52 V54 I69 Y70 G85 S86 K87	D52-V72 HydrophobicContact CB-CG2 4.06Å; V54-V72 HydrophobicContact CB-CG2 4.14Å; V54-V72 HydrophobicContact CG2-CG2 4.16Å; V54-V72 PolarHBondContact O-N 2.84Å; I69-V72 VanDerWaalsContact CG2-O 3.31Å; I69-V72 WeakPolarHBondContact CG2-O 3.46Å; Y70-V72 VanDerWaalsContact C-N 3.26Å; Y70-V72 PolarHBondContact O-N 3.38Å; V72-G85 CarbonylContact O-C 3.58Å; V72-G85 WeakPolarHBondContact O-CA 3.27Å; V72-S86 PolarHBondContact O-N 3.01Å; V72-K87 HydrophobicContact CG1-CB 3.5Å; V72-K87 HydrophobicContact CG2-CB 4.28Å; V72-K87 HydrophobicContact CG2-CD 4.39Å
73	N	97.9	Very high	95.4	Very high	108 Å²	108	62.3 Å²	62.3	58%	0.578	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-137.8	-1.3	-168.5	65.4	7.4	0	0	0	114.3	N71 G85	N71-N73 PolarHBondContact O-N 3.46Å; N71-N73 PolarHBondContact O-OD1 2.87Å; N73-G85 VanDerWaalsContact CB-O 3.31Å; N73-G85 WeakPolarHBondContact CB-O 3.37Å
74	T	98.2	Very high	96.4	Very high	48 Å²	48	61.7 Å²	61.7	29%	0.294	36%	0.355	S	S	.	.	B	Isolated β-bridge	trans	-90.6	124.8	-175.2	-50.7	0	0	0	0	110.6	I69 Y70	I69-T74 CarbonylContact C-O 3.52Å; I69-T74 VanDerWaalsContact CA-O 3.31Å; I69-T74 WeakPolarHBondContact CA-O 3.31Å; Y70-T74 HydrophobicContact CD1-CG2 4.33Å; Y70-T74 WeakPolarHBondContact CD1-O 3.2Å; Y70-T74 HydrophobicContact CE1-CG2 3.55Å; Y70-T74 HydrophobicContact CE2-CG2 3.76Å; Y70-T74 PolarHBondContact N-O 3.44Å; Y70-T74 WeakPolarHBondContact O-CA 3.45Å; Y70-T74 VanDerWaalsContact O-CB 3.29Å; Y70-T74 WeakPolarHBondContact O-CB 3.14Å; Y70-T74 PolarHBondContact O-N 2.9Å; Y70-T74 WeakPolarHBondContact OH-CG2 3.3Å
75	R	98.2	Very high	96.9	Very high	101 Å²	101	56 Å²	56	38%	0.381	32%	0.323	S	S	.	.	P	Polyproline II helix	trans	-97.8	125.7	-179.3	-178.7	168.7	55.3	-141.2	3.9	110.4	I69 I79 S80 D81 F83	I69-R75 HydrophobicContact CD1-CB 3.95Å; I69-R75 HydrophobicContact CD1-CG 4.38Å; R75-I79 HydrophobicContact CG-CB 3.55Å; R75-I79 HydrophobicContact CG-CG1 4.4Å; R75-I79 HydrophobicContact CG-CG2 3.71Å; R75-S80 WeakPolarHBondContact CD-O 3.28Å; R75-D81 PolarHBondContact NH1-O 2.68Å; R75-D81 VanDerWaalsContact NH1-O 3.15Å; R75-F83 PolarHBondContact NH1-O 3.25Å
76	P	97.8	Very high	97.3	Very high	31 Å²	31	55.7 Å²	55.7	20%	0.201	32%	0.321	C	S	.	.	P	Polyproline II helix	trans	-59.9	154.7	172.2	-21.1	31.4	0	0	0	112.9	L67 L68 Y70 I79	L67-P76 HydrophobicContact CD2-CG 3.92Å; L67-P76 HydrophobicContact CG-CG 4.02Å; L68-P76 WeakPolarHBondContact O-CD 3.34Å; Y70-P76 HydrophobicContact CD1-CG 3.79Å; Y70-P76 HydrophobicContact CE1-CG 3.99Å; P76-I79 HydrophobicContact CB-CG1 4Å; P76-I79 HydrophobicContact CG-CG1 4.21Å; P76-I79 WeakPolarHBondContact O-CB 3.31Å; P76-I79 WeakPolarHBondContact O-CG1 3.34Å; P76-I79 PolarHBondContact O-N 2.86Å
77	S	97.1	Very high	97.4	Very high	130 Å²	130	52.8 Å²	52.8	91%	0.909	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.4	138.5	173.1	-65.3	0	0	0	0	111.5	I79	S77-I79 VanDerWaalsContact C-N 3.3Å; S77-I79 PolarHBondContact O-N 2.02Å
78	G	96	Very high	97.4	Very high	68 Å²	68	55 Å²	55	70%	0.701	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.2	3.2	-179.7	0	0	0	0	0	115.3	R66	R66-G78 PolarHBondContact NH2-O 2.99Å
79	I	96.9	Very high	97.3	Very high	19 Å²	19	57.5 Å²	57.5	10%	0.097	36%	0.357	C	S	.	.			trans	-88.4	137.3	167.2	-55.4	-63	0	0	0	109.3	R66 L67 L68 R75 P76 S77 F83	R66-I79 HydrophobicContact CG-CD1 4.19Å; L67-I79 WeakPolarHBondContact O-CD1 3.2Å; L68-I79 HydrophobicContact CD2-CD1 4.42Å; L68-I79 HydrophobicContact CD2-CG2 4.27Å; R75-I79 HydrophobicContact CG-CB 3.55Å; R75-I79 HydrophobicContact CG-CG1 4.4Å; R75-I79 HydrophobicContact CG-CG2 3.71Å; P76-I79 HydrophobicContact CB-CG1 4Å; P76-I79 HydrophobicContact CG-CG1 4.21Å; P76-I79 WeakPolarHBondContact O-CB 3.31Å; P76-I79 WeakPolarHBondContact O-CG1 3.34Å; P76-I79 PolarHBondContact O-N 2.86Å; S77-I79 VanDerWaalsContact C-N 3.3Å; S77-I79 PolarHBondContact O-N 2.02Å; I79-F83 HydrophobicContact CG2-CB 4.48Å; I79-F83 HydrophobicContact CG2-CD2 3.87Å
80	S	96.3	Very high	97.2	Very high	48 Å²	48	60.8 Å²	60.8	34%	0.336	38%	0.375	S	S	.	.			trans	-61.6	148.8	-178.3	171.3	0	0	0	0	112.3	R75 L82 F83	R75-S80 WeakPolarHBondContact CD-O 3.28Å; S80-L82 PolarHBondContact O-N 2.84Å; S80-L82 VanDerWaalsContact OG-CG 3.27Å; S80-L82 WeakPolarHBondContact OG-CG 3.31Å; S80-L82 PolarHBondContact OG-N 3.19Å; S80-F83 PolarHBondContact O-N 3.35Å
81	D	96.3	Very high	97.2	Very high	120 Å²	120	60.7 Å²	60.7	64%	0.642	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65	-15.5	176.6	63.8	-24.4	0	0	0	114.9	R75 F83	R75-D81 PolarHBondContact NH1-O 2.68Å; R75-D81 VanDerWaalsContact NH1-O 3.15Å; D81-F83 PolarHBondContact O-N 2.85Å
82	L	97.1	Very high	97.3	Very high	34 Å²	34	57.7 Å²	57.7	18%	0.178	36%	0.362	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-24	176.3	-58.7	176	0	0	0	113.5	S80 I96 S97	S80-L82 PolarHBondContact O-N 2.84Å; S80-L82 VanDerWaalsContact OG-CG 3.27Å; S80-L82 WeakPolarHBondContact OG-CG 3.31Å; S80-L82 PolarHBondContact OG-N 3.19Å; L82-I96 WeakPolarHBondContact O-CA 3.35Å; L82-S97 WeakPolarHBondContact CA-OG 3.32Å; L82-S97 WeakPolarHBondContact CD2-O 3.19Å; L82-S97 PolarHBondContact O-N 3.27Å; L82-S97 PolarHBondContact O-OG 3.13Å
83	F	98.2	Very high	97.3	Very high	10 Å²	10	58.1 Å²	58.1	4%	0.044	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	124.6	-179.5	-57.3	-77.2	0	0	0	110.9	L68 R75 I79 S80 D81 L94 I96 V103 Y107	L68-F83 HydrophobicContact CD1-CD1 3.84Å; L68-F83 HydrophobicContact CD1-CE1 3.96Å; L68-F83 HydrophobicContact CD1-CG 4.37Å; L68-F83 HydrophobicContact CD2-CD2 4.39Å; L68-F83 HydrophobicContact CD2-CE2 4.34Å; L68-F83 HydrophobicContact CD2-CZ 4.44Å; R75-F83 PolarHBondContact NH1-O 3.25Å; I79-F83 HydrophobicContact CG2-CB 4.48Å; I79-F83 HydrophobicContact CG2-CD2 3.87Å; S80-F83 PolarHBondContact O-N 3.35Å; D81-F83 PolarHBondContact O-N 2.85Å; F83-L94 HydrophobicContact CB-CD1 4.39Å; F83-L94 HydrophobicContact CD1-CD1 4.46Å; F83-I96 HydrophobicContact CD1-CG1 3.98Å; F83-I96 HydrophobicContact CD1-CG2 4.33Å; F83-I96 HydrophobicContact CE1-CD1 4.17Å; F83-I96 HydrophobicContact CE1-CG1 4.07Å; F83-I96 HydrophobicContact CE1-CG2 4.02Å; F83-V103 HydrophobicContact CE1-CG1 4.49Å; F83-V103 HydrophobicContact CZ-CG1 3.88Å; F83-Y107 AromaticContact CE1-CE1 3.95Å; F83-Y107 HydrophobicContact CE1-CE1 3.95Å
84	S	98.4	Very high	97.4	Very high	56 Å²	56	53 Å²	53	39%	0.392	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	147.1	170.9	61.2	0	0	0	0	111	L94 T95	S84-L94 CarbonylContact O-C 3.59Å; S84-L94 WeakPolarHBondContact O-CA 3.27Å; S84-T95 PolarHBondContact N-O 3.28Å; S84-T95 PolarHBondContact O-N 2.81Å
85	G	98.4	Very high	97.4	Very high	12 Å²	12	52.3 Å²	52.3	12%	0.124	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	150.6	177.8	0	0	0	0	0	112.1	V72 N73 S93	V72-G85 CarbonylContact O-C 3.58Å; V72-G85 WeakPolarHBondContact O-CA 3.27Å; N73-G85 VanDerWaalsContact CB-O 3.31Å; N73-G85 WeakPolarHBondContact CB-O 3.37Å; G85-S93 CarbonylContact C-O 3.5Å; G85-S93 VanDerWaalsContact CA-O 3.28Å; G85-S93 WeakPolarHBondContact CA-O 2.97Å
86	S	98.3	Very high	97.4	Very high	59 Å²	59	47.7 Å²	47.7	41%	0.413	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.6	168.2	175.2	65.7	0	0	0	0	111.2	V72 A92 S93	V72-S86 PolarHBondContact O-N 3.01Å; S86-A92 CarbonylContact O-C 3.46Å; S86-A92 WeakPolarHBondContact O-CA 3.36Å; S86-S93 PolarHBondContact N-O 2.94Å; S86-S93 PolarHBondContact O-N 3.36Å
87	K	97.1	Very high	97.4	Very high	55 Å²	55	48.2 Å²	48.2	24%	0.239	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	143.2	173.6	-176.1	-178.4	68.7	166.8	0	110.3	V48 G49 Y51 D52 V72 G89 M91	V48-K87 HydrophobicContact CG1-CD 3.88Å; V48-K87 HydrophobicContact CG1-CG 4.26Å; V48-K87 WeakPolarHBondContact O-CD 3.2Å; V48-K87 PolarHBondContact O-NZ 3.28Å; G49-K87 PolarHBondContact O-NZ 2.97Å; Y51-K87 PolarHBondContact O-NZ 2.86Å; D52-K87 WeakPolarHBondContact OD1-CE 3.07Å; D52-K87 IonicContact OD1-NZ 2.68Å; D52-K87 PolarHBondContact OD1-NZ 3.3Å; V72-K87 HydrophobicContact CG1-CB 3.5Å; V72-K87 HydrophobicContact CG2-CB 4.28Å; V72-K87 HydrophobicContact CG2-CD 4.39Å; K87-G89 WeakPolarHBondContact CD-O 3Å; K87-G89 WeakPolarHBondContact CG-O 3.48Å; K87-M91 CarbonylContact C-O 3.15Å; K87-M91 WeakPolarHBondContact CA-O 3.12Å
88	S	97.1	Very high	97.4	Very high	99 Å²	99	43 Å²	43	69%	0.692	29%	0.288	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-138.5	119.1	166.5	-178.4	0	0	0	0	109.1	N90 M91	S88-N90 PolarHBondContact O-N 2.85Å; S88-M91 PolarHBondContact N-O 3.32Å; S88-M91 PolarHBondContact O-N 3.47Å
89	G	95.8	Very high	97.4	Very high	53 Å²	53	40.9 Å²	40.9	55%	0.546	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.2	-128.4	-172.9	0	0	0	0	0	111.5	G49 K87 M91	G49-G89 WeakPolarHBondContact CA-O 3.23Å; K87-G89 WeakPolarHBondContact CD-O 3Å; K87-G89 WeakPolarHBondContact CG-O 3.48Å; G89-M91 VanDerWaalsContact C-N 3.29Å; G89-M91 PolarHBondContact O-N 3.03Å
90	N	95.3	Very high	97.3	Very high	70 Å²	70	46.2 Å²	46.2	37%	0.374	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.1	14.6	177.8	65.1	-30.5	0	0	0	114.3	G43 T44 V48 S88	G43-N90 PolarHBondContact N-O 3.12Å; G43-N90 PolarHBondContact O-ND2 2.88Å; T44-N90 WeakPolarHBondContact O-CB 3.19Å; V48-N90 VanDerWaalsContact CG1-C 3.42Å; V48-N90 WeakPolarHBondContact CG1-O 3.41Å; S88-N90 PolarHBondContact O-N 2.85Å
91	M	97.3	Very high	97	Very high	80 Å²	80	48.8 Å²	48.8	39%	0.394	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	115.6	-179.9	-172.2	-179.1	-63.8	0	0	110.8	K87 S88 G89	K87-M91 CarbonylContact C-O 3.15Å; K87-M91 WeakPolarHBondContact CA-O 3.12Å; S88-M91 PolarHBondContact N-O 3.32Å; S88-M91 PolarHBondContact O-N 3.47Å; G89-M91 VanDerWaalsContact C-N 3.29Å; G89-M91 PolarHBondContact O-N 3.03Å
92	A	97.9	Very high	96.8	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	157.2	167.2	0	0	0	0	0	110.8	S40 C41 V48 V54 S86	S40-A92 WeakPolarHBondContact CA-O 3.49Å; C41-A92 HydrophobicContact CB-CB 4.33Å; C41-A92 PolarHBondContact N-O 2.91Å; C41-A92 PolarHBondContact O-N 2.92Å; V48-A92 HydrophobicContact CG1-CB 4.22Å; V54-A92 HydrophobicContact CB-CB 4.2Å; V54-A92 HydrophobicContact CG1-CB 3.71Å; V54-A92 HydrophobicContact CG2-CB 3.96Å; S86-A92 CarbonylContact O-C 3.46Å; S86-A92 WeakPolarHBondContact O-CA 3.36Å
93	S	98.4	Very high	96.6	Very high	20 Å²	20	48.8 Å²	48.8	14%	0.14	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	140.1	-178.5	-70.7	0	0	0	0	110.7	I39 G85 S86	I39-S93 CarbonylContact O-C 3.58Å; I39-S93 WeakPolarHBondContact O-CA 3.49Å; G85-S93 CarbonylContact C-O 3.5Å; G85-S93 VanDerWaalsContact CA-O 3.28Å; G85-S93 WeakPolarHBondContact CA-O 2.97Å; S86-S93 PolarHBondContact N-O 2.94Å; S86-S93 PolarHBondContact O-N 3.36Å
94	L	98.7	Very high	96.4	Very high	0 Å²	0	56.1 Å²	56.1	0%	0	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	116	165.2	175.6	71.1	0	0	0	108.1	T38 I39 W56 L68 I69 F83 S84 I96 Y107	T38-L94 CarbonylContact C-O 3.53Å; T38-L94 WeakPolarHBondContact CA-O 3.27Å; I39-L94 HydrophobicContact CD1-CD2 4.45Å; I39-L94 PolarHBondContact N-O 3.31Å; I39-L94 PolarHBondContact O-N 3.05Å; W56-L94 HydrophobicContact CB-CD1 4.3Å; W56-L94 HydrophobicContact CB-CD2 4.33Å; W56-L94 HydrophobicContact CD2-CB 3.48Å; W56-L94 VanDerWaalsContact CD2-CB 3.48Å; W56-L94 HydrophobicContact CD2-CD2 4.08Å; W56-L94 HydrophobicContact CD2-CG 4.24Å; W56-L94 HydrophobicContact CE3-CB 3.69Å; W56-L94 HydrophobicContact CE3-CD2 3.78Å; W56-L94 HydrophobicContact CE3-CG 4.34Å; W56-L94 HydrophobicContact CG-CB 3.98Å; W56-L94 HydrophobicContact CG-CD1 4.19Å; W56-L94 HydrophobicContact CG-CD2 4.32Å; W56-L94 HydrophobicContact CG-CG 4.41Å; W56-L94 HydrophobicContact CH2-CB 3.95Å; W56-L94 HydrophobicContact CZ2-CB 3.76Å; W56-L94 HydrophobicContact CZ3-CB 3.92Å; W56-L94 HydrophobicContact CZ3-CD2 4.38Å; L68-L94 HydrophobicContact CD1-CD2 4.01Å; I69-L94 HydrophobicContact CG1-CD1 3.87Å; F83-L94 HydrophobicContact CB-CD1 4.39Å; F83-L94 HydrophobicContact CD1-CD1 4.46Å; S84-L94 CarbonylContact O-C 3.59Å; S84-L94 WeakPolarHBondContact O-CA 3.27Å; L94-I96 HydrophobicContact CD2-CD1 4.43Å; L94-I96 HydrophobicContact CD2-CG1 4.38Å; L94-I96 HydrophobicContact CG-CG1 4.27Å; L94-Y107 HydrophobicContact CD2-CD1 3.66Å; L94-Y107 HydrophobicContact CD2-CE1 4.21Å; L94-Y107 HydrophobicContact CD2-CG 4.32Å
95	T	98.6	Very high	96.3	Very high	34 Å²	34	54.8 Å²	54.8	21%	0.209	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	131.2	171.5	-62.5	0	0	0	0	109.3	V37 T38 S84	V37-T95 WeakPolarHBondContact O-CA 3.44Å; T38-T95 PolarHBondContact OG1-OG1 3.47Å; T38-T95 VanDerWaalsContact OG1-OG1 3.06Å; S84-T95 PolarHBondContact N-O 3.28Å; S84-T95 PolarHBondContact O-N 2.81Å
96	I	98.4	Very high	96.2	Very high	3 Å²	3	59.3 Å²	59.3	2%	0.015	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	109.4	174.2	-49.9	176	0	0	0	106.3	S36 V37 I39 L82 F83 L94 L99 V103 Y107	S36-I96 CarbonylContact C-O 3.58Å; S36-I96 VanDerWaalsContact CA-O 3.23Å; S36-I96 WeakPolarHBondContact CA-O 3.35Å; V37-I96 HydrophobicContact CG2-CB 4.07Å; V37-I96 PolarHBondContact N-O 2.98Å; V37-I96 PolarHBondContact O-N 3.27Å; I39-I96 HydrophobicContact CD1-CD1 4.14Å; L82-I96 WeakPolarHBondContact O-CA 3.35Å; F83-I96 HydrophobicContact CD1-CG1 3.98Å; F83-I96 HydrophobicContact CD1-CG2 4.33Å; F83-I96 HydrophobicContact CE1-CD1 4.17Å; F83-I96 HydrophobicContact CE1-CG1 4.07Å; F83-I96 HydrophobicContact CE1-CG2 4.02Å; L94-I96 HydrophobicContact CD2-CD1 4.43Å; L94-I96 HydrophobicContact CD2-CG1 4.38Å; L94-I96 HydrophobicContact CG-CG1 4.27Å; I96-L99 HydrophobicContact CG2-CD2 4.08Å; I96-V103 HydrophobicContact CG2-CB 4.22Å; I96-V103 HydrophobicContact CG2-CG1 4.41Å; I96-V103 HydrophobicContact CG2-CG2 4.06Å; I96-Y107 HydrophobicContact CD1-CD1 4.39Å; I96-Y107 HydrophobicContact CD1-CD2 4.36Å; I96-Y107 HydrophobicContact CD1-CE1 3.83Å; I96-Y107 HydrophobicContact CD1-CE2 3.81Å
97	S	97.9	Very high	96.1	Very high	42 Å²	42	58.1 Å²	58.1	29%	0.294	33%	0.332	S	S	.	.			trans	-89.5	157.7	177.5	66.5	0	0	0	0	111.5	S36 L82 L99	S36-S97 WeakPolarHBondContact OG-CA 3.48Å; L82-S97 WeakPolarHBondContact CA-OG 3.32Å; L82-S97 WeakPolarHBondContact CD2-O 3.19Å; L82-S97 PolarHBondContact O-N 3.27Å; L82-S97 PolarHBondContact O-OG 3.13Å; S97-L99 PolarHBondContact O-N 3.03Å
98	G	96.4	Very high	96	Very high	21 Å²	21	60.7 Å²	60.7	22%	0.216	35%	0.345	C	S	.	.	S	Bend	trans	56.9	54.1	171.9	0	0	0	0	0	113.5	Q35 K100	Q35-G98 PolarHBondContact O-N 2.5Å; Q35-G98 VanDerWaalsContact O-N 3.14Å; G98-K100 WeakPolarHBondContact O-CG 3.39Å; G98-K100 PolarHBondContact O-N 2.6Å
99	L	96.7	Very high	96	Very high	24 Å²	24	56 Å²	56	13%	0.126	31%	0.312	C	S	.	.			trans	-49.1	133.2	-177.2	-78.3	-177.4	0	0	0	113.1	P33 G34 Q35 V37 I96 S97 V103	P33-L99 WeakPolarHBondContact CA-O 3.26Å; G34-L99 PolarHBondContact N-O 2.83Å; Q35-L99 WeakPolarHBondContact O-CG 3.48Å; Q35-L99 PolarHBondContact O-N 2.96Å; V37-L99 HydrophobicContact CG1-CD1 3.66Å; V37-L99 HydrophobicContact CG2-CD1 4.15Å; V37-L99 HydrophobicContact CG2-CD2 3.86Å; V37-L99 HydrophobicContact CG2-CG 4.28Å; I96-L99 HydrophobicContact CG2-CD2 4.08Å; S97-L99 PolarHBondContact O-N 3.03Å; L99-V103 HydrophobicContact CD2-CG2 3.68Å
100	K	94.3	Very high	95.9	Very high	130 Å²	130	54.9 Å²	54.9	57%	0.565	30%	0.295	S	S	*	.			trans	-142.5	162.4	177.4	-65.7	172.5	-168.8	178.2	0	108.8	G98 E102 V103	G98-K100 WeakPolarHBondContact O-CG 3.39Å; G98-K100 PolarHBondContact O-N 2.6Å; K100-E102 PolarHBondContact O-N 2.98Å; K100-E102 VanDerWaalsContact O-N 3.1Å; K100-V103 WeakPolarHBondContact O-CG2 3.49Å; K100-V103 PolarHBondContact O-N 3.4Å; K100-V103 VanDerWaalsContact O-N 3.1Å
101	S	90.7	Very high	95.6	Very high	103 Å²	103	53.5 Å²	53.5	72%	0.72	29%	0.288	S	S	*	.	G	3₁₀ helix	trans	-55.7	-30.5	178.2	51.6	0	0	0	0	113.3	V103 E104	S101-V103 VanDerWaalsContact C-N 3.26Å; S101-V103 PolarHBondContact O-N 3.14Å; S101-E104 WeakPolarHBondContact O-CB 3.17Å; S101-E104 PolarHBondContact O-N 3.04Å
102	E	91.3	Very high	94.7	Very high	140 Å²	140	57.1 Å²	57.1	65%	0.654	30%	0.298	S	S	*	.	G	3₁₀ helix	trans	-64.1	-26.4	179.9	-63.8	173.7	-158.6	0	0	113.8	R60 K100 E104	R60-E102 PolarHBondContact NE-O 3.32Å; R60-E102 PolarHBondContact NH2-O 2.75Å; K100-E102 PolarHBondContact O-N 2.98Å; K100-E102 VanDerWaalsContact O-N 3.1Å; E102-E104 VanDerWaalsContact C-N 3.34Å
103	V	93.6	Very high	93.1	Very high	13 Å²	13	61.5 Å²	61.5	8%	0.079	33%	0.329	C	S	.	.	G	3₁₀ helix	trans	-92.6	6.8	-178.7	-60	0	0	0	0	112.9	F83 I96 L99 K100 S101 A105 Y107	F83-V103 HydrophobicContact CE1-CG1 4.49Å; F83-V103 HydrophobicContact CZ-CG1 3.88Å; I96-V103 HydrophobicContact CG2-CB 4.22Å; I96-V103 HydrophobicContact CG2-CG1 4.41Å; I96-V103 HydrophobicContact CG2-CG2 4.06Å; L99-V103 HydrophobicContact CD2-CG2 3.68Å; K100-V103 WeakPolarHBondContact O-CG2 3.49Å; K100-V103 PolarHBondContact O-N 3.4Å; K100-V103 VanDerWaalsContact O-N 3.1Å; S101-V103 VanDerWaalsContact C-N 3.26Å; S101-V103 PolarHBondContact O-N 3.14Å; V103-A105 PolarHBondContact O-N 2.97Å; V103-Y107 PolarHBondContact O-OH 2.94Å
104	E	94.6	Very high	90.8	Very high	164 Å²	164	62.3 Å²	62.3	77%	0.766	34%	0.335	S	S	*	.			trans	-70.9	113.2	170.2	-167.6	177.8	154.6	0	0	110.1	S101 E102	S101-E104 WeakPolarHBondContact O-CB 3.17Å; S101-E104 PolarHBondContact O-N 3.04Å; E102-E104 VanDerWaalsContact C-N 3.34Å
105	A	95.2	Very high	88.5	Confident	28 Å²	28	66.6 Å²	66.6	23%	0.231	36%	0.364	C	S	.	.	S	Bend	trans	-165.8	172.7	-175.3	0	0	0	0	0	111.6	Q58 R60 V103 Y107	Q58-A105 HydrophobicContact CG-CB 3.49Å; Q58-A105 VanDerWaalsContact CG-CB 3.49Å; R60-A105 HydrophobicContact CG-CB 3.95Å; V103-A105 PolarHBondContact O-N 2.97Å; A105-Y107 HydrophobicContact CB-CE2 3.93Å; A105-Y107 VanDerWaalsContact O-CD2 3.31Å; A105-Y107 WeakPolarHBondContact O-CD2 3.3Å; A105-Y107 WeakPolarHBondContact O-CE2 3.31Å
106	N	96.1	Very high	85.9	Confident	108 Å²	108	74 Å²	74	58%	0.578	39%	0.39	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.3	133.4	165.8	-64.5	-59.4	0	0	0	109.9	Q58 K59	Q58-N106 CarbonylContact C-O 3.6Å; K59-N106 HydrophobicContact CB-CB 4.43Å; K59-N106 PolarHBondContact N-O 3.46Å; K59-N106 PolarHBondContact O-N 2.77Å
107	Y	97	Very high	82.9	Confident	33 Å²	33	79.2 Å²	79.2	13%	0.129	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	131.7	179.7	-64.9	-87.7	0	0	0	110.5	Q25 I39 Y57 Q58 L68 F83 L94 I96 V103 A105	Q25-Y107 PolarHBondContact NE2-O 2.84Å; I39-Y107 HydrophobicContact CD1-CD1 4.46Å; I39-Y107 HydrophobicContact CD1-CD2 3.65Å; I39-Y107 HydrophobicContact CD1-CE2 4.45Å; I39-Y107 HydrophobicContact CD1-CG 3.65Å; Y57-Y107 WeakPolarHBondContact O-CA 3.35Å; Q58-Y107 HydrophobicContact CB-CD1 4.34Å; Q58-Y107 HydrophobicContact CB-CE1 4.07Å; Q58-Y107 HydrophobicContact CG-CD1 4.37Å; Q58-Y107 HydrophobicContact CG-CE1 3.8Å; Q58-Y107 PolarHBondContact NE2-OH 3.32Å; L68-Y107 HydrophobicContact CD1-CD1 3.75Å; L68-Y107 HydrophobicContact CD1-CE1 3.59Å; F83-Y107 AromaticContact CE1-CE1 3.95Å; F83-Y107 HydrophobicContact CE1-CE1 3.95Å; L94-Y107 HydrophobicContact CD2-CD1 3.66Å; L94-Y107 HydrophobicContact CD2-CE1 4.21Å; L94-Y107 HydrophobicContact CD2-CG 4.32Å; I96-Y107 HydrophobicContact CD1-CD1 4.39Å; I96-Y107 HydrophobicContact CD1-CD2 4.36Å; I96-Y107 HydrophobicContact CD1-CE1 3.83Å; I96-Y107 HydrophobicContact CD1-CE2 3.81Å; V103-Y107 PolarHBondContact O-OH 2.94Å; A105-Y107 HydrophobicContact CB-CE2 3.93Å; A105-Y107 VanDerWaalsContact O-CD2 3.31Å; A105-Y107 WeakPolarHBondContact O-CD2 3.3Å; A105-Y107 WeakPolarHBondContact O-CE2 3.31Å
108	H	95.4	Very high	80	Confident	110 Å²	110	90 Å²	90	51%	0.509	46%	0.464	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	134.2	-178.2	176.3	-95.5	0	0	0	110.7	Y57	Y57-H108 PolarHBondContact N-O 2.83Å; Y57-H108 PolarHBondContact O-N 3.32Å
109	C	96.2	Very high	79.2	Confident	0 Å²	0	93.5 Å²	93.5	0%	0	48%	0.477	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	146	170.9	65.8	0	0	0	0	110.9	Q25 C41 V54 F55 W56	Q25-C109 PolarHBondContact OE1-SG 2.77Å; C41-C109 HydrophobicContact CB-CB 3.49Å; C41-C109 VanDerWaalsContact CB-CB 3.49Å; C41-C109 WeakPolarHBondContact CB-SG 3.21Å; C41-C109 WeakPolarHBondContact SG-CB 3.34Å; C41-C109 CovalentContact SG-SG 2.02Å; C41-C109 PolarHBondContact SG-SG 2.93Å; V54-C109 HydrophobicContact CG1-CB 4.48Å; F55-C109 CarbonylContact O-C 3.53Å; F55-C109 WeakPolarHBondContact O-CA 3.29Å; W56-C109 HydrophobicContact CD2-CB 4.14Å; W56-C109 HydrophobicContact CE3-CB 4.01Å; W56-C109 HydrophobicContact CH2-CB 4.04Å; W56-C109 HydrophobicContact CZ2-CB 4.16Å; W56-C109 HydrophobicContact CZ3-CB 3.96Å
110	S	93.8	Very high	78.3	Confident	29 Å²	29	97.2 Å²	97.2	20%	0.203	50%	0.495	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	163.4	169.8	78.5	0	0	0	0	111.2	V54 F55 Y57	V54-S110 WeakPolarHBondContact CA-O 3.45Å; F55-S110 PolarHBondContact N-O 2.96Å; F55-S110 PolarHBondContact O-N 2.83Å; Y57-S110 WeakPolarHBondContact CE2-OG 3.14Å
111	L	90.3	Very high	77.4	Confident	42 Å²	42	95.3 Å²	95.3	22%	0.22	49%	0.491	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	149.7	171.5	-65.8	177.1	0	0	0	110.7	L23 D47 V48 H53 V54 S113	L23-L111 HydrophobicContact CD1-CG 4.09Å; L23-L111 HydrophobicContact CD2-CD1 3.88Å; L23-L111 HydrophobicContact CD2-CG 4.14Å; D47-L111 HydrophobicContact CB-CD1 3.48Å; D47-L111 VanDerWaalsContact CB-CD1 3.48Å; V48-L111 HydrophobicContact CG2-CD1 4.14Å; V48-L111 HydrophobicContact CG2-CD2 4.02Å; V48-L111 HydrophobicContact CG2-CG 4.48Å; H53-L111 WeakPolarHBondContact O-CA 3.21Å; V54-L111 HydrophobicContact CB-CD2 4.38Å; V54-L111 HydrophobicContact CG2-CD2 3.64Å; L111-S113 PolarHBondContact O-N 3.49Å
112	Y	77.6	Confident	76.6	Confident	155 Å²	155	94.9 Å²	94.9	61%	0.608	48%	0.478	S	S	*	.			trans	-75.4	104.1	158.7	-173.6	-102.6	0	0	0	108	H53 S114	H53-Y112 PolarHBondContact O-N 2.95Å; H53-Y112 VanDerWaalsContact O-N 3.13Å; Y112-S114 PolarHBondContact O-N 3Å
113	S	63.8	Low	75.7	Confident	92 Å²	92	92.1 Å²	92.1	64%	0.643	47%	0.467	S	S	*	.			trans	-78.4	97.6	168.5	-174.1	0	0	0	0	107.8	L111 S115	L111-S113 PolarHBondContact O-N 3.49Å; S113-S115 VanDerWaalsContact C-N 3.25Å; S113-S115 PolarHBondContact O-N 3.38Å
114	S	51.4	Low	74.5	Confident	37 Å²	37	97.3 Å²	97.3	26%	0.259	49%	0.493	S	S	.	.			trans	-71.7	93.3	158.4	57.9	0	0	0	0	106.2	Y112 Y116	Y112-S114 PolarHBondContact O-N 3Å; S114-Y116 PolarHBondContact O-N 3.18Å; S114-Y116 VanDerWaalsContact OG-CD2 3.31Å; S114-Y116 WeakPolarHBondContact OG-CD2 3.22Å; S114-Y116 VanDerWaalsContact OG-CE2 3.3Å; S114-Y116 WeakPolarHBondContact OG-CE2 3.44Å
115	S	49	Very low	73	Confident	90 Å²	90	92.6 Å²	92.6	63%	0.629	47%	0.473	S	S	*	.			trans	-64.9	80.5	164.4	56.3	0	0	0	0	107.9	S113 T117	S113-S115 VanDerWaalsContact C-N 3.25Å; S113-S115 PolarHBondContact O-N 3.38Å; S115-T117 PolarHBondContact O-N 3.36Å
116	Y	43.5	Very low	71.3	Confident	191 Å²	191	97.5 Å²	97.5	75%	0.749	49%	0.492	S	S	*	.			trans	-75.5	78.4	161	-72.1	-72.3	0	0	0	106.4	S114 F118	S114-Y116 PolarHBondContact O-N 3.18Å; S114-Y116 VanDerWaalsContact OG-CD2 3.31Å; S114-Y116 WeakPolarHBondContact OG-CD2 3.22Å; S114-Y116 VanDerWaalsContact OG-CE2 3.3Å; S114-Y116 WeakPolarHBondContact OG-CE2 3.44Å; Y116-F118 PolarHBondContact O-N 3.01Å
117	T	37.1	Very low	69.3	Low	111 Å²	111	96.7 Å²	96.7	68%	0.681	49%	0.485	S	S	*	.			trans	-69.6	109.8	164.9	42	0	0	0	0	108	S115	S115-T117 PolarHBondContact O-N 3.36Å
118	F	36.2	Very low	66.8	Low	270 Å²	270	102.5 Å²	102.5	100%	1.184	52%	0.517	S	S	*	.			trans	-100.1	0	146.1	-74.1	-78.5	0	0	0	108.1	Y116	Y116-F118 PolarHBondContact O-N 3.01Å

Retrieved 118 of 118 residues in 123.3 ms (Link to these results)

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