A0A087WUY6_HUMAN Loading...

MAGI family member, X-linked

AlphaFold DB , UniProt , Accession A0A087WUY6, Species HUMAN (Homo sapiens, Human), Gene MAGIX, Length 258 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	43.3	Very low	47.1	Very low	244 Å²	244	138.2 Å²	138.2	100%	1.202	80%	0.803	S	S	*	*				0	111.9	0	-88.8	171.7	154.3	0	0	107.3
2	E	47.8	Very low	46.6	Very low	151 Å²	151	147.8 Å²	147.8	71%	0.706	82%	0.815	S	S	*	*			trans	-64.2	159	158.5	-72.7	-164.4	101.8	0	0	109.3	R4	E2-R4 IonicContact OE2-NE 2.76Å
3	P	58.1	Low	46.3	Very low	126 Å²	126	141.8 Å²	141.8	82%	0.818	81%	0.808	S	S	*	*				-132.5	133.3	117.2	33.4	-21.8	0	0	0	113
4	R	48	Very low	46.5	Very low	198 Å²	198	141.2 Å²	141.2	75%	0.747	82%	0.817	S	S	*	*			trans	-68.3	151.9	155.4	-62.1	178.4	177.1	177.1	-4.5	108.8	E2	E2-R4 IonicContact OE2-NE 2.76Å
5	T	49.2	Very low	46.6	Very low	144 Å²	144	148 Å²	148	88%	0.883	82%	0.824	S	S	*	*				167.1	133.1	110.9	-48.4	0	0	0	0	111.3
6	G	44.4	Very low	46.1	Very low	64 Å²	64	143.6 Å²	143.6	66%	0.66	82%	0.823	S	S	*	*			trans	86.8	100.7	142.9	0	0	0	0	0	115.6
7	D	40.7	Very low	45.8	Very low	165 Å²	165	139.3 Å²	139.3	88%	0.882	82%	0.817	S	S	*	*				59.9	102.8	57.5	-152.8	-91.1	0	0	0	113.7
8	A	45.1	Very low	45.7	Very low	95 Å²	95	145.2 Å²	145.2	79%	0.785	82%	0.823	S	S	*	*			trans	-161.4	95.9	157.5	0	0	0	0	0	110.5
9	A	41.6	Very low	45	Very low	88 Å²	88	141.3 Å²	141.3	73%	0.727	82%	0.818	S	S	*	*			trans	31.6	117	140.1	0	0	0	0	0	120.2
10	D	46.2	Very low	45	Very low	150 Å²	150	140.3 Å²	140.3	80%	0.802	82%	0.816	S	S	*	*				95.4	162.3	80	-162.5	-109.9	0	0	0	111.2
11	P	53.6	Low	45.2	Very low	95 Å²	95	138.4 Å²	138.4	62%	0.617	81%	0.811	S	S	*	*			cis	-118.8	158.9	-30.8	23.5	-6.2	0	0	0	111.9
12	R	41.3	Very low	45.4	Very low	253 Å²	253	132.8 Å²	132.8	96%	0.955	79%	0.793	S	S	*	*			trans	172.5	122.9	137.1	-102.7	164.4	180	-108.4	0.5	110.4
13	G	42.1	Very low	45.2	Very low	70 Å²	70	134 Å²	134	72%	0.722	80%	0.803	S	S	*	*			trans	144.5	61.5	157.8	0	0	0	0	0	114.7	R15	G13-R15 PolarHBondContact O-N 2.66Å
14	S	49.6	Very low	44.9	Very low	134 Å²	134	132.6 Å²	132.6	94%	0.937	80%	0.802	S	S	*	*			trans	-49.7	105.3	155.4	-69.6	0	0	0	0	109.9
15	R	48.2	Very low	45.4	Very low	243 Å²	243	125.8 Å²	125.8	92%	0.917	79%	0.793	S	S	*	*			trans	-121.9	87.2	162.5	-142.6	-179.7	-164.5	-173	3.9	103.8	G13	G13-R15 PolarHBondContact O-N 2.66Å
16	G	38.8	Very low	45.7	Very low	78 Å²	78	122.6 Å²	122.6	80%	0.804	78%	0.775	S	S	*	*				68.4	110.4	76.6	0	0	0	0	0	107.8
17	G	40.8	Very low	46.6	Very low	70 Å²	70	123.1 Å²	123.1	72%	0.722	77%	0.769	S	S	*	*			cis	-167	173.7	-1.9	0	0	0	0	0	107.2	G19	G17-G19 PolarHBondContact O-N 2.83Å; G17-G19 VanDerWaalsContact O-N 3.1Å
18	R	43.9	Very low	47.2	Very low	246 Å²	246	118.4 Å²	118.4	93%	0.928	75%	0.753	S	S	*	*	S	Bend	trans	-40	121.9	154	-78.7	177.8	175.8	-150.1	-3	107.8	P20	R18-P20 WeakPolarHBondContact O-CD 3.25Å
19	G	31.9	Very low	47.5	Very low	70 Å²	70	124.2 Å²	124.2	72%	0.722	75%	0.754	S	S	*	*			trans	-51.5	116.2	169.9	0	0	0	0	0	108	G17 S21	G17-G19 PolarHBondContact O-N 2.83Å; G17-G19 VanDerWaalsContact O-N 3.1Å; G19-S21 PolarHBondContact O-N 3.33Å
20	P	44.5	Very low	48.3	Very low	121 Å²	121	125.9 Å²	125.9	79%	0.786	75%	0.747	S	S	*	*			trans	-65.6	137.2	167	27.8	-30	0	0	0	107	R18	R18-P20 WeakPolarHBondContact O-CD 3.25Å
21	S	50.2	Low	48.7	Very low	102 Å²	102	123.3 Å²	123.3	71%	0.713	73%	0.733	S	S	*	*			trans	-34.1	149.4	176.2	-47.3	0	0	0	0	113.6	G19 L23	G19-S21 PolarHBondContact O-N 3.33Å; S21-L23 PolarHBondContact O-N 3.29Å; S21-L23 VanDerWaalsContact O-N 3.11Å
22	P	46.6	Very low	48.7	Very low	126 Å²	126	124.6 Å²	124.6	82%	0.818	73%	0.734	S	S	*	*			trans	-51.2	125.8	174.7	-20.1	30.3	0	0	0	109.4	A24	P22-A24 VanDerWaalsContact C-N 3.26Å; P22-A24 PolarHBondContact O-N 3.47Å
23	L	44.9	Very low	49.2	Very low	176 Å²	176	115.9 Å²	115.9	92%	0.921	72%	0.716	S	S	*	*			trans	-51.8	96.9	165	-78.6	152.7	0	0	0	107.1	S21 G25	S21-L23 PolarHBondContact O-N 3.29Å; S21-L23 VanDerWaalsContact O-N 3.11Å; L23-G25 PolarHBondContact O-N 3.46Å
24	A	50.6	Low	49.8	Very low	96 Å²	96	122.8 Å²	122.8	79%	0.793	72%	0.72	S	S	*	*			trans	-59.1	106.6	171.3	0	0	0	0	0	106.3	P22	P22-A24 VanDerWaalsContact C-N 3.26Å; P22-A24 PolarHBondContact O-N 3.47Å
25	G	59.3	Low	49.9	Very low	55 Å²	55	122.2 Å²	122.2	57%	0.567	71%	0.706	S	S	*	*	P	Polyproline II helix	trans	-51.8	150.8	169	0	0	0	0	0	109.4	L23 S27	L23-G25 PolarHBondContact O-N 3.46Å; G25-S27 PolarHBondContact O-N 3.43Å
26	P	54.8	Low	50	Low	78 Å²	78	117.4 Å²	117.4	51%	0.506	70%	0.698	S	S	.	*	P	Polyproline II helix	trans	-52.1	121.8	-177.1	21.4	-31.8	0	0	0	109.3	Q30	P26-Q30 HydrophobicContact CB-CB 4.23Å
27	S	64.6	Low	50.6	Low	74 Å²	74	116.1 Å²	116.1	52%	0.517	68%	0.681	S	S	.	*	P	Polyproline II helix	trans	-53.4	147.8	178.1	171.3	0	0	0	0	109.5	G25 R29 Q30 L31	G25-S27 PolarHBondContact O-N 3.43Å; S27-R29 PolarHBondContact O-N 2.78Å; S27-Q30 WeakPolarHBondContact O-CA 2.98Å; S27-Q30 WeakPolarHBondContact O-CB 3.42Å; S27-Q30 PolarHBondContact O-N 2.88Å; S27-L31 PolarHBondContact O-N 2.89Å
28	A	52.3	Low	51.1	Low	67 Å²	67	123.7 Å²	123.7	55%	0.554	69%	0.687	S	S	*	*	H	α-helix	trans	-48.1	-27.9	177.7	0	0	0	0	0	113.4	L31 L32	A28-L31 PolarHBondContact O-N 2.89Å; A28-L32 WeakPolarHBondContact O-CD1 3.21Å; A28-L32 PolarHBondContact O-N 2.99Å
29	R	52.2	Low	51.5	Low	216 Å²	216	115.8 Å²	115.8	82%	0.815	67%	0.668	S	S	*	*	H	α-helix	trans	-65.8	-34.8	173.6	-69.2	-175.4	168.3	176.9	-3.4	113.9	S27 L32 A33	S27-R29 PolarHBondContact O-N 2.78Å; R29-L32 PolarHBondContact O-N 3.13Å; R29-A33 PolarHBondContact O-N 2.88Å
30	Q	57.4	Low	52.3	Low	124 Å²	124	118.3 Å²	118.3	58%	0.579	66%	0.664	S	S	*	*	H	α-helix	trans	-80.2	-25.8	178.5	-151	160.4	24.1	0	0	112.1	P26 S27	P26-Q30 HydrophobicContact CB-CB 4.23Å; S27-Q30 WeakPolarHBondContact O-CA 2.98Å; S27-Q30 WeakPolarHBondContact O-CB 3.42Å; S27-Q30 PolarHBondContact O-N 2.88Å
31	L	54.4	Low	52.4	Low	95 Å²	95	116.3 Å²	116.3	50%	0.497	66%	0.658	S	S	.	*	H	α-helix	trans	-73.4	-38.8	166.8	-71	170.7	0	0	0	111.6	S27 A28 R34 L35	S27-L31 PolarHBondContact O-N 2.89Å; A28-L31 PolarHBondContact O-N 2.89Å; L31-R34 PolarHBondContact O-N 2.73Å; L31-L35 PolarHBondContact O-N 2.92Å
32	L	54	Low	52.3	Low	123 Å²	123	114.3 Å²	114.3	64%	0.644	65%	0.648	S	S	*	*	H	α-helix	trans	-63.2	-39.1	172.2	-104.8	83.3	0	0	0	112.3	A28 R29 R34 L35	A28-L32 WeakPolarHBondContact O-CD1 3.21Å; A28-L32 PolarHBondContact O-N 2.99Å; R29-L32 PolarHBondContact O-N 3.13Å; L32-R34 PolarHBondContact O-N 3.15Å; L32-L35 WeakPolarHBondContact O-CB 3.2Å; L32-L35 PolarHBondContact O-N 2.91Å
33	A	52.7	Low	52.1	Low	69 Å²	69	117.3 Å²	117.3	57%	0.57	64%	0.643	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.3	-18.7	176.4	0	0	0	0	0	113.7	R29	R29-A33 PolarHBondContact O-N 2.88Å
34	R	53.8	Low	52.4	Low	215 Å²	215	111.5 Å²	111.5	81%	0.811	62%	0.62	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.2	-12.9	172.1	-72.6	-176.8	171.9	-156.6	-1.6	113.2	L31 L32 D36	L31-R34 PolarHBondContact O-N 2.73Å; L32-R34 PolarHBondContact O-N 3.15Å; R34-D36 PolarHBondContact O-N 3.2Å
35	L	51.4	Low	52.1	Low	123 Å²	123	109.7 Å²	109.7	64%	0.644	61%	0.605	S	S	*	*			trans	-90.8	44.1	171.8	-64.7	172.8	0	0	0	110.4	L31 L32 A37	L31-L35 PolarHBondContact O-N 2.92Å; L32-L35 WeakPolarHBondContact O-CB 3.2Å; L32-L35 PolarHBondContact O-N 2.91Å; L35-A37 PolarHBondContact O-N 3.17Å
36	D	51.2	Low	51.5	Low	141 Å²	141	111.5 Å²	111.5	75%	0.754	61%	0.605	S	S	*	*			trans	-68.2	77.1	160.4	-113.4	-41.2	0	0	0	107.6	R34 R38	R34-D36 PolarHBondContact O-N 3.2Å; D36-R38 PolarHBondContact O-N 3.19Å
37	A	50.8	Low	51.4	Low	52 Å²	52	113.1 Å²	113.1	43%	0.43	61%	0.609	S	S	.	*			trans	-79	53.4	-164.3	0	0	0	0	0	111.8	L35 P39 L40	L35-A37 PolarHBondContact O-N 3.17Å; A37-P39 VanDerWaalsContact C-N 3.35Å; A37-L40 HydrophobicContact CB-CD1 4.05Å
38	R	51.8	Low	50.4	Low	228 Å²	228	113.8 Å²	113.8	86%	0.86	61%	0.61	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.8	-7.3	163	-73.2	-159.6	174	-162.4	-0.1	116.2	D36	D36-R38 PolarHBondContact O-N 3.19Å
39	P	52.6	Low	50	Low	80 Å²	80	112.7 Å²	112.7	52%	0.519	60%	0.601	S	S	.	*	T	Hydrogen-bonded Turn	trans	-96.6	2	174	34.8	-25.8	0	0	0	114.5	A37 R43	A37-P39 VanDerWaalsContact C-N 3.35Å; P39-R43 PolarHBondContact O-N 3.01Å
40	L	47.3	Very low	49.9	Very low	124 Å²	124	104.4 Å²	104.4	65%	0.649	58%	0.578	S	S	*	*	H	α-helix	trans	-86.5	-36.7	-179.7	-100.1	148.5	0	0	0	113.1	A37 A44	A37-L40 HydrophobicContact CB-CD1 4.05Å; L40-A44 WeakPolarHBondContact O-CB 3.26Å; L40-A44 PolarHBondContact O-N 3.15Å; L40-A44 VanDerWaalsContact O-N 3.17Å
41	A	47.5	Very low	49.5	Very low	78 Å²	78	103.1 Å²	103.1	65%	0.645	58%	0.575	S	S	*	*	H	α-helix	trans	-68.6	-34.8	173.3	0	0	0	0	0	112.5	A45	A41-A45 PolarHBondContact O-N 3.29Å
42	A	47.1	Very low	49.4	Very low	61 Å²	61	102 Å²	102	50%	0.504	57%	0.572	S	S	.	*	H	α-helix	trans	-74.3	-33.9	178.6	0	0	0	0	0	113	V46	A42-V46 WeakPolarHBondContact O-CG2 3.45Å; A42-V46 PolarHBondContact O-N 2.96Å
43	R	43.9	Very low	49.1	Very low	189 Å²	189	104.7 Å²	104.7	71%	0.713	57%	0.574	S	S	*	*	H	α-helix	trans	-71	-41.8	174.9	-130.7	105	167.8	-166.3	-2.9	111.6	P39 A45 V46 D47	P39-R43 PolarHBondContact O-N 3.01Å; R43-A45 VanDerWaalsContact C-N 3.3Å; R43-A45 PolarHBondContact O-N 2.76Å; R43-V46 PolarHBondContact O-N 2.76Å; R43-D47 PolarHBondContact O-N 2.93Å
44	A	49.6	Very low	48.7	Very low	54 Å²	54	109.6 Å²	109.6	45%	0.446	58%	0.578	S	S	.	*	H	α-helix	trans	-61.3	-37.6	176.4	0	0	0	0	0	112.3	L40 D47 V48	L40-A44 WeakPolarHBondContact O-CB 3.26Å; L40-A44 PolarHBondContact O-N 3.15Å; L40-A44 VanDerWaalsContact O-N 3.17Å; A44-D47 PolarHBondContact O-N 2.83Å; A44-V48 VanDerWaalsContact O-CG2 3.25Å; A44-V48 WeakPolarHBondContact O-CG2 3.22Å; A44-V48 PolarHBondContact O-N 3.43Å
45	A	45	Very low	48.5	Very low	58 Å²	58	100.6 Å²	100.6	48%	0.479	55%	0.549	S	S	.	.	H	α-helix	trans	-67.3	-35.3	177.5	0	0	0	0	0	113.4	A41 R43 V48 A49	A41-A45 PolarHBondContact O-N 3.29Å; R43-A45 VanDerWaalsContact C-N 3.3Å; R43-A45 PolarHBondContact O-N 2.76Å; A45-V48 PolarHBondContact O-N 3.46Å; A45-A49 WeakPolarHBondContact O-CB 3.31Å; A45-A49 PolarHBondContact O-N 3.23Å
46	V	47.3	Very low	48.4	Very low	93 Å²	93	96.7 Å²	96.7	56%	0.564	54%	0.538	S	S	*	.	H	α-helix	trans	-68.2	-39.4	176.8	173.2	0	0	0	0	111.1	A42 R43 A49 A50	A42-V46 WeakPolarHBondContact O-CG2 3.45Å; A42-V46 PolarHBondContact O-N 2.96Å; R43-V46 PolarHBondContact O-N 2.76Å; V46-A49 PolarHBondContact O-N 2.81Å; V46-A50 VanDerWaalsContact O-CB 3.3Å; V46-A50 WeakPolarHBondContact O-CB 2.93Å; V46-A50 PolarHBondContact O-N 3.03Å
47	D	51.9	Low	48.1	Very low	112 Å²	112	93.9 Å²	93.9	60%	0.599	53%	0.534	S	S	*	.	H	α-helix	trans	-70	-36.3	176.2	-78.8	-28.3	0	0	0	112.4	R43 A44 A50 L51	R43-D47 PolarHBondContact O-N 2.93Å; A44-D47 PolarHBondContact O-N 2.83Å; D47-A50 PolarHBondContact O-N 2.65Å; D47-L51 VanDerWaalsContact O-CB 3.27Å; D47-L51 WeakPolarHBondContact O-CB 3.36Å; D47-L51 PolarHBondContact O-N 2.94Å
48	V	43.9	Very low	47.7	Very low	87 Å²	87	92.9 Å²	92.9	53%	0.527	52%	0.523	S	S	.	.	H	α-helix	trans	-65.9	-44.8	173.2	173	0	0	0	0	110.8	A44 A45 A50 L51 V52	A44-V48 VanDerWaalsContact O-CG2 3.25Å; A44-V48 WeakPolarHBondContact O-CG2 3.22Å; A44-V48 PolarHBondContact O-N 3.43Å; A45-V48 PolarHBondContact O-N 3.46Å; V48-A50 VanDerWaalsContact C-N 3.3Å; V48-A50 PolarHBondContact O-N 3.1Å; V48-L51 PolarHBondContact O-N 3.39Å; V48-V52 HydrophobicContact CG1-CG2 4.28Å; V48-V52 WeakPolarHBondContact O-CB 3.15Å; V48-V52 WeakPolarHBondContact O-CG2 3.42Å; V48-V52 PolarHBondContact O-N 2.98Å
49	A	44.1	Very low	47.5	Very low	44 Å²	44	84 Å²	84	36%	0.364	49%	0.492	S	S	.	.	H	α-helix	trans	-66.5	-31.4	176.1	0	0	0	0	0	112.6	A45 V46 R53	A45-A49 WeakPolarHBondContact O-CB 3.31Å; A45-A49 PolarHBondContact O-N 3.23Å; V46-A49 PolarHBondContact O-N 2.81Å; A49-R53 VanDerWaalsContact O-CB 3.31Å; A49-R53 WeakPolarHBondContact O-CB 3.43Å; A49-R53 VanDerWaalsContact O-CG 3.23Å; A49-R53 WeakPolarHBondContact O-CG 3.19Å; A49-R53 PolarHBondContact O-N 3.39Å; A49-R53 PolarHBondContact O-NE 3.15Å
50	A	49.1	Very low	47.4	Very low	42 Å²	42	87 Å²	87	35%	0.347	49%	0.494	S	S	.	.	H	α-helix	trans	-71.6	-41	172.7	0	0	0	0	0	111.9	V46 D47 V48 R53 R54	V46-A50 VanDerWaalsContact O-CB 3.3Å; V46-A50 WeakPolarHBondContact O-CB 2.93Å; V46-A50 PolarHBondContact O-N 3.03Å; D47-A50 PolarHBondContact O-N 2.65Å; V48-A50 VanDerWaalsContact C-N 3.3Å; V48-A50 PolarHBondContact O-N 3.1Å; A50-R53 PolarHBondContact O-N 2.76Å; A50-R54 VanDerWaalsContact O-CB 3.25Å; A50-R54 WeakPolarHBondContact O-CB 3.48Å; A50-R54 PolarHBondContact O-N 3.44Å
51	L	50.9	Low	47.6	Very low	97 Å²	97	81.8 Å²	81.8	51%	0.508	47%	0.466	S	S	.	.	H	α-helix	trans	-62.1	-44.4	172.9	-172.1	78.4	0	0	0	111.1	D47 V48 R54 A55 P83	D47-L51 VanDerWaalsContact O-CB 3.27Å; D47-L51 WeakPolarHBondContact O-CB 3.36Å; D47-L51 PolarHBondContact O-N 2.94Å; V48-L51 PolarHBondContact O-N 3.39Å; L51-R54 PolarHBondContact O-N 3.15Å; L51-A55 WeakPolarHBondContact O-CB 3.18Å; L51-A55 PolarHBondContact O-N 3.11Å; L51-P83 HydrophobicContact CD1-CG 4.28Å
52	V	51.3	Low	47.7	Very low	72 Å²	72	84.9 Å²	84.9	44%	0.436	46%	0.461	S	S	.	.	H	α-helix	trans	-65.3	-41.4	177	169.8	0	0	0	0	111.6	V48 G56	V48-V52 HydrophobicContact CG1-CG2 4.28Å; V48-V52 WeakPolarHBondContact O-CB 3.15Å; V48-V52 WeakPolarHBondContact O-CG2 3.42Å; V48-V52 PolarHBondContact O-N 2.98Å; V52-G56 PolarHBondContact O-N 3.11Å
53	R	46.9	Very low	47.7	Very low	180 Å²	180	91.6 Å²	91.6	68%	0.679	47%	0.474	S	S	*	.	H	α-helix	trans	-67.9	-35.5	174.2	-76.9	-176.4	-66.2	-178.9	2	112.3	A49 A50 A57	A49-R53 VanDerWaalsContact O-CB 3.31Å; A49-R53 WeakPolarHBondContact O-CB 3.43Å; A49-R53 VanDerWaalsContact O-CG 3.23Å; A49-R53 WeakPolarHBondContact O-CG 3.19Å; A49-R53 PolarHBondContact O-N 3.39Å; A49-R53 PolarHBondContact O-NE 3.15Å; A50-R53 PolarHBondContact O-N 2.76Å; R53-A57 PolarHBondContact O-N 2.97Å
54	R	46.2	Very low	47.9	Very low	172 Å²	172	88.2 Å²	88.2	65%	0.649	46%	0.464	S	S	*	.	H	α-helix	trans	-71.9	-46	176.7	-155.9	176.4	-158.7	-151.1	5.8	111.3	A50 L51 A57 T58	A50-R54 VanDerWaalsContact O-CB 3.25Å; A50-R54 WeakPolarHBondContact O-CB 3.48Å; A50-R54 PolarHBondContact O-N 3.44Å; L51-R54 PolarHBondContact O-N 3.15Å; R54-A57 CarbonylContact O-C 3.59Å; R54-A57 PolarHBondContact O-N 2.95Å; R54-A57 VanDerWaalsContact O-N 3.12Å; R54-T58 WeakPolarHBondContact O-CB 2.96Å; R54-T58 VanDerWaalsContact O-CG2 3.28Å; R54-T58 WeakPolarHBondContact O-CG2 3.34Å; R54-T58 PolarHBondContact O-N 3.26Å; R54-T58 PolarHBondContact O-OG1 3.42Å
55	A	49	Very low	47.7	Very low	26 Å²	26	94.1 Å²	94.1	22%	0.215	48%	0.482	C	S	.	.	H	α-helix	trans	-64.6	-38.4	176	0	0	0	0	0	112	L51 A57 T58 L59	L51-A55 WeakPolarHBondContact O-CB 3.18Å; L51-A55 PolarHBondContact O-N 3.11Å; A55-A57 PolarHBondContact O-N 3.14Å; A55-T58 PolarHBondContact O-N 2.89Å; A55-L59 HydrophobicContact CB-CD1 3.89Å; A55-L59 VanDerWaalsContact O-CB 3.24Å; A55-L59 WeakPolarHBondContact O-CB 3.49Å; A55-L59 PolarHBondContact O-N 3.35Å
56	G	48.7	Very low	47.5	Very low	40 Å²	40	95.5 Å²	95.5	41%	0.412	49%	0.494	S	S	.	.	H	α-helix	trans	-64.9	-24.6	173	0	0	0	0	0	114	V52	V52-G56 PolarHBondContact O-N 3.11Å
57	A	44.6	Very low	47.2	Very low	82 Å²	82	97.8 Å²	97.8	68%	0.678	51%	0.508	S	S	*	.	H	α-helix	trans	-93.2	-15	176.1	0	0	0	0	0	113.6	R53 R54 A55	R53-A57 PolarHBondContact O-N 2.97Å; R54-A57 CarbonylContact O-C 3.59Å; R54-A57 PolarHBondContact O-N 2.95Å; R54-A57 VanDerWaalsContact O-N 3.12Å; A55-A57 PolarHBondContact O-N 3.14Å
58	T	43.5	Very low	46.4	Very low	32 Å²	32	97.1 Å²	97.1	20%	0.196	51%	0.512	C	S	.	.	H	α-helix	trans	-118.3	-19.7	-173.5	64.4	0	0	0	0	115.1	R54 A55 R60 D79	R54-T58 WeakPolarHBondContact O-CB 2.96Å; R54-T58 VanDerWaalsContact O-CG2 3.28Å; R54-T58 WeakPolarHBondContact O-CG2 3.34Å; R54-T58 PolarHBondContact O-N 3.26Å; R54-T58 PolarHBondContact O-OG1 3.42Å; A55-T58 PolarHBondContact O-N 2.89Å; T58-R60 PolarHBondContact O-N 3.21Å; T58-R60 VanDerWaalsContact O-N 3.09Å; T58-D79 WeakPolarHBondContact CB-OD2 3.44Å; T58-D79 PolarHBondContact OG1-OD2 2.94Å
59	L	46.2	Very low	46.2	Very low	40 Å²	40	100 Å²	100	21%	0.209	53%	0.53	C	S	.	.			trans	-79.1	91.7	173.1	-76.9	160.3	0	0	0	110.4	A55 L61 V77 D79 L82	A55-L59 HydrophobicContact CB-CD1 3.89Å; A55-L59 VanDerWaalsContact O-CB 3.24Å; A55-L59 WeakPolarHBondContact O-CB 3.49Å; A55-L59 PolarHBondContact O-N 3.35Å; L59-L61 PolarHBondContact O-N 3.49Å; L59-V77 HydrophobicContact CD2-CG1 3.87Å; L59-D79 HydrophobicContact CD2-CB 3.64Å; L59-D79 HydrophobicContact CG-CB 4.22Å; L59-L82 HydrophobicContact CD1-CD2 3.97Å; L59-L82 HydrophobicContact CD2-CD1 4.01Å; L59-L82 HydrophobicContact CD2-CD2 3.83Å; L59-L82 HydrophobicContact CD2-CG 4.04Å; L59-L82 HydrophobicContact CG-CD2 4.25Å
60	R	50.8	Low	45.9	Very low	144 Å²	144	105.1 Å²	105.1	54%	0.543	55%	0.55	S	S	.	.			trans	-89.3	99.6	171.3	-58.7	-174.1	79.5	-125.7	8.5	107.8	T58 T78	T58-R60 PolarHBondContact O-N 3.21Å; T58-R60 VanDerWaalsContact O-N 3.09Å; R60-T78 PolarHBondContact O-N 3.05Å; R60-T78 PolarHBondContact O-OG1 3.36Å
61	L	51.1	Low	45.8	Very low	15 Å²	15	108.4 Å²	108.4	8%	0.079	56%	0.562	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-91.4	128.7	171.2	-67.2	167	0	0	0	107.8	L59 I75 E76 V77 H111 V115 I118	L59-L61 PolarHBondContact O-N 3.49Å; L61-I75 HydrophobicContact CB-CG2 3.87Å; L61-I75 HydrophobicContact CD1-CG2 4.38Å; L61-I75 HydrophobicContact CD2-CG2 3.71Å; L61-I75 HydrophobicContact CG-CG2 4.18Å; L61-E76 WeakPolarHBondContact CA-O 3.08Å; L61-V77 HydrophobicContact CD2-CB 3.77Å; L61-V77 HydrophobicContact CD2-CG1 4.03Å; L61-V77 HydrophobicContact CD2-CG2 3.3Å; L61-H111 WeakPolarHBondContact CB-CE1 3.33Å; L61-H111 PolarHBondContact O-CE1 3.14Å; L61-V115 HydrophobicContact CD1-CG2 3.5Å; L61-V115 VanDerWaalsContact CD1-CG2 3.5Å; L61-I118 HydrophobicContact CD1-CD1 4.17Å
62	R	49.6	Very low	45.4	Very low	143 Å²	143	106.7 Å²	106.7	54%	0.54	56%	0.558	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-106.6	132.3	175.5	-68.8	-62.2	-160.8	179.8	11.3	109	K64 E76	R62-K64 PolarHBondContact O-N 2.88Å; R62-E76 PolarHBondContact N-O 3.36Å; R62-E76 PolarHBondContact O-N 3.46Å
63	R	47.5	Very low	45.2	Very low	202 Å²	202	104.6 Å²	104.6	76%	0.762	55%	0.548	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.1	119.1	167.4	-178.4	-177.2	-175.2	-174.2	1.8	106.9
64	K	49.1	Very low	45.2	Very low	118 Å²	118	98.8 Å²	98.8	51%	0.513	53%	0.53	S	S	.	.	P	Polyproline II helix	trans	-80.3	128.7	171.8	-167.1	171.6	177.2	179.2	0	108.7	R62 A66 D74	R62-K64 PolarHBondContact O-N 2.88Å; K64-A66 PolarHBondContact O-N 3.11Å; K64-D74 HydrophobicContact CB-CB 3.95Å; K64-D74 WeakPolarHBondContact CB-O 2.86Å; K64-D74 HydrophobicContact CD-CB 4.02Å; K64-D74 PolarHBondContact N-O 3.15Å
65	E	45.6	Very low	45.6	Very low	177 Å²	177	91 Å²	91	83%	0.827	50%	0.502	S	S	*	.	P	Polyproline II helix	trans	-66.6	124.3	-177.8	-64.5	174.6	-170.4	0	0	109.5	V67	E65-V67 PolarHBondContact O-N 3.48Å
66	A	40.6	Very low	45.9	Very low	88 Å²	88	92.4 Å²	92.4	73%	0.727	50%	0.504	S	S	*	.	P	Polyproline II helix	trans	-74	119.4	-169.6	0	0	0	0	0	111	K64	K64-A66 PolarHBondContact O-N 3.11Å
67	V	39.6	Very low	46	Very low	140 Å²	140	91.3 Å²	91.3	85%	0.848	49%	0.489	S	S	*	.			trans	-115.7	66.2	164.1	-166.8	0	0	0	0	108.4	E65	E65-V67 PolarHBondContact O-N 3.48Å
68	S	36.2	Very low	46.1	Very low	98 Å²	98	90.2 Å²	90.2	69%	0.685	47%	0.474	S	S	*	.	S	Bend	trans	173	145.4	148.7	50.6	0	0	0	0	112.2	L70	S68-L70 PolarHBondContact O-N 3.11Å
69	V	38.9	Very low	46	Very low	149 Å²	149	89.4 Å²	89.4	90%	0.903	47%	0.468	S	S	*	.	S	Bend	trans	-71.3	17.3	-168	169.2	0	0	0	0	115.1
70	L	38.8	Very low	45.9	Very low	150 Å²	150	91.2 Å²	91.2	79%	0.785	48%	0.484	S	S	*	.	S	Bend	trans	-119.3	87.2	170.6	-70	171.4	0	0	0	109.1	S68 S72	S68-L70 PolarHBondContact O-N 3.11Å; L70-S72 PolarHBondContact O-N 3.45Å; L70-S72 VanDerWaalsContact O-N 3.11Å
71	D	45.8	Very low	45.5	Very low	112 Å²	112	91.1 Å²	91.1	60%	0.599	48%	0.484	S	S	*	.			trans	-17.7	100.6	172.4	-162.7	32.7	0	0	0	113.7	Q107 G108	D71-Q107 WeakPolarHBondContact O-CG 3.44Å; D71-Q107 PolarHBondContact O-NE2 2.89Å; D71-G108 WeakPolarHBondContact OD2-CA 3.3Å
72	S	44.6	Very low	45.4	Very low	61 Å²	61	92.7 Å²	92.7	43%	0.427	49%	0.492	S	S	.	.			trans	-149.9	106.8	168.5	-69.4	0	0	0	0	106.5	L70 D74	L70-S72 PolarHBondContact O-N 3.45Å; L70-S72 VanDerWaalsContact O-N 3.11Å; S72-D74 PolarHBondContact O-N 2.75Å; S72-D74 VanDerWaalsContact O-N 3.15Å
73	A	46	Very low	44.9	Very low	28 Å²	28	89.5 Å²	89.5	23%	0.231	49%	0.49	C	S	.	.			trans	-79.7	95.9	177.1	0	0	0	0	0	108.4	I75 L109	A73-I75 PolarHBondContact O-N 2.92Å; A73-I75 VanDerWaalsContact O-N 3.14Å; A73-L109 WeakPolarHBondContact CB-O 3.42Å
74	D	47.8	Very low	44.5	Very low	58 Å²	58	87.4 Å²	87.4	31%	0.31	49%	0.489	S	S	.	.			trans	-67.4	110.3	172.3	-70.2	-39.1	0	0	0	109.1	K64 S72 L97	K64-D74 HydrophobicContact CB-CB 3.95Å; K64-D74 WeakPolarHBondContact CB-O 2.86Å; K64-D74 HydrophobicContact CD-CB 4.02Å; K64-D74 PolarHBondContact N-O 3.15Å; S72-D74 PolarHBondContact O-N 2.75Å; S72-D74 VanDerWaalsContact O-N 3.15Å; D74-L97 HydrophobicContact CB-CD2 4.04Å
75	I	54.3	Low	44.3	Very low	8 Å²	8	82.8 Å²	82.8	4%	0.041	47%	0.472	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	114.1	177	-58.3	171.2	0	0	0	108.2	L61 A73 A114	L61-I75 HydrophobicContact CB-CG2 3.87Å; L61-I75 HydrophobicContact CD1-CG2 4.38Å; L61-I75 HydrophobicContact CD2-CG2 3.71Å; L61-I75 HydrophobicContact CG-CG2 4.18Å; A73-I75 PolarHBondContact O-N 2.92Å; A73-I75 VanDerWaalsContact O-N 3.14Å; I75-A114 HydrophobicContact CD1-CB 3.32Å
76	E	55.2	Low	44.2	Very low	56 Å²	56	78 Å²	78	26%	0.262	46%	0.455	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	130.2	178.1	-170.4	-172.4	161.8	0	0	110.6	L61 R62 V94 G95	L61-E76 WeakPolarHBondContact CA-O 3.08Å; R62-E76 PolarHBondContact N-O 3.36Å; R62-E76 PolarHBondContact O-N 3.46Å; E76-V94 WeakPolarHBondContact OE1-CG1 3.34Å; E76-G95 PolarHBondContact OE1-N 3.17Å
77	V	51.2	Low	44.6	Very low	17 Å²	17	76 Å²	76	10%	0.103	43%	0.432	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	111.9	-179.7	-174.7	0	0	0	0	109.9	L59 L61 L82 V98	L59-V77 HydrophobicContact CD2-CG1 3.87Å; L61-V77 HydrophobicContact CD2-CB 3.77Å; L61-V77 HydrophobicContact CD2-CG1 4.03Å; L61-V77 HydrophobicContact CD2-CG2 3.3Å; V77-L82 HydrophobicContact CG1-CD1 4.25Å; V77-V98 HydrophobicContact CG2-CG2 3.67Å
78	T	46.6	Very low	44.7	Very low	59 Å²	59	75 Å²	75	36%	0.362	43%	0.426	S	S	.	.			trans	-96.8	15.5	-178.1	-28.6	0	0	0	0	114.8	R60 V94	R60-T78 PolarHBondContact O-N 3.05Å; R60-T78 PolarHBondContact O-OG1 3.36Å; T78-V94 HydrophobicContact CG2-CG1 4.15Å; T78-V94 HydrophobicContact CG2-CG2 3.86Å
79	D	40.8	Very low	45.3	Very low	15 Å²	15	76.8 Å²	76.8	8%	0.08	43%	0.428	C	S	.	.			trans	-101.5	113.6	-176.8	-162	7.8	0	0	0	112.9	T58 L59 R81	T58-D79 WeakPolarHBondContact CB-OD2 3.44Å; T58-D79 PolarHBondContact OG1-OD2 2.94Å; L59-D79 HydrophobicContact CD2-CB 3.64Å; L59-D79 HydrophobicContact CG-CB 4.22Å; D79-R81 PolarHBondContact O-N 3.49Å; D79-R81 IonicContact OD1-NE 3.87Å; D79-R81 IonicContact OD1-NH2 3.93Å
80	S	43.9	Very low	45.8	Very low	78 Å²	78	74.4 Å²	74.4	55%	0.545	41%	0.407	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.8	6.7	-177.1	53.8	0	0	0	0	114.5	R91	S80-R91 PolarHBondContact O-NH2 2.97Å
81	R	42.8	Very low	46.7	Very low	142 Å²	142	76 Å²	76	54%	0.536	40%	0.402	S	S	.	.	T	Hydrogen-bonded Turn	trans	-121.2	10.2	-170.3	-65.7	-179.3	-66.9	-171.4	-7.7	115.6	D79 P83	D79-R81 PolarHBondContact O-N 3.49Å; D79-R81 IonicContact OD1-NE 3.87Å; D79-R81 IonicContact OD1-NH2 3.93Å; R81-P83 WeakPolarHBondContact O-CD 3.43Å
82	L	48.3	Very low	47.3	Very low	48 Å²	48	72.1 Å²	72.1	25%	0.251	38%	0.383	S	S	.	.			trans	-59.7	109.3	171.2	-73.5	175.8	0	0	0	109.6	L59 V77	L59-L82 HydrophobicContact CD1-CD2 3.97Å; L59-L82 HydrophobicContact CD2-CD1 4.01Å; L59-L82 HydrophobicContact CD2-CD2 3.83Å; L59-L82 HydrophobicContact CD2-CG 4.04Å; L59-L82 HydrophobicContact CG-CD2 4.25Å; V77-L82 HydrophobicContact CG1-CD1 4.25Å
83	P	39	Very low	47.9	Very low	76 Å²	76	74.9 Å²	74.9	49%	0.494	39%	0.389	S	S	.	.			trans	-88.6	128.6	178	29.6	-16.2	0	0	0	108.4	L51 R81	L51-P83 HydrophobicContact CD1-CG 4.28Å; R81-P83 WeakPolarHBondContact O-CD 3.43Å
84	H	40.3	Very low	48.3	Very low	158 Å²	158	78.2 Å²	78.2	73%	0.731	41%	0.406	S	S	*	.			trans	67.2	39.9	172.4	-44.2	-73.2	0	0	0	116.9	T86	H84-T86 PolarHBondContact O-N 2.95Å
85	A	44.2	Very low	48.9	Very low	20 Å²	20	76.4 Å²	76.4	17%	0.165	40%	0.402	C	S	.	.	B	Isolated β-bridge	trans	-62.7	118.6	142.2	0	0	0	0	0	105.5	I87	A85-I87 HydrophobicContact CB-CD1 3.76Å; A85-I87 HydrophobicContact CB-CG1 3.42Å; A85-I87 VanDerWaalsContact CB-CG1 3.42Å; A85-I87 PolarHBondContact O-N 3.28Å
86	T	44.2	Very low	49.4	Very low	76 Å²	76	76.8 Å²	76.8	47%	0.466	40%	0.404	S	S	.	.			trans	-67.7	72	165.8	23.5	0	0	0	0	106.4	H84 V88 H126	H84-T86 PolarHBondContact O-N 2.95Å; T86-V88 PolarHBondContact O-N 3.07Å; T86-H126 PolarHBondContact OG1-CD2 3.21Å; T86-H126 PolarHBondContact OG1-NE2 3.46Å; T86-H126 VanDerWaalsContact OG1-NE2 3.17Å
87	I	47.7	Very low	50	Low	46 Å²	46	75 Å²	75	24%	0.236	40%	0.396	C	S	.	.			trans	-81.3	113.5	175.6	-49.8	159.1	0	0	0	103.7	A85 D89 H90 P92	A85-I87 HydrophobicContact CB-CD1 3.76Å; A85-I87 HydrophobicContact CB-CG1 3.42Å; A85-I87 VanDerWaalsContact CB-CG1 3.42Å; A85-I87 PolarHBondContact O-N 3.28Å; I87-D89 PolarHBondContact O-N 2.77Å; I87-H90 VanDerWaalsContact CD1-O 3.31Å; I87-H90 WeakPolarHBondContact CD1-O 3.15Å; I87-H90 HydrophobicContact CG2-CB 4.44Å; I87-H90 WeakPolarHBondContact CG2-O 3.13Å; I87-P92 HydrophobicContact CD1-CG 3.59Å
88	V	42.9	Very low	50.8	Low	121 Å²	121	74.8 Å²	74.8	73%	0.733	39%	0.394	S	S	*	.	S	Bend	trans	-58.1	101.5	163.6	-168.6	0	0	0	0	105.1	T86 H90	T86-V88 PolarHBondContact O-N 3.07Å; V88-H90 PolarHBondContact O-N 3.31Å
89	D	48.3	Very low	51.8	Low	135 Å²	135	74.9 Å²	74.9	72%	0.722	39%	0.393	S	S	*	.	S	Bend	trans	74	-9.3	166.3	-60	-58.4	0	0	0	122.2	I87	I87-D89 PolarHBondContact O-N 2.77Å
90	H	50.3	Low	53.3	Low	99 Å²	99	77.4 Å²	77.4	46%	0.458	40%	0.404	S	S	.	.			trans	-141.1	114.9	-170.2	-45.8	-47	0	0	0	114.9	I87 V88 R131	I87-H90 VanDerWaalsContact CD1-O 3.31Å; I87-H90 WeakPolarHBondContact CD1-O 3.15Å; I87-H90 HydrophobicContact CG2-CB 4.44Å; I87-H90 WeakPolarHBondContact CG2-O 3.13Å; V88-H90 PolarHBondContact O-N 3.31Å; H90-R131 PolarHBondContact CD2-NH2 3.22Å; H90-R131 VanDerWaalsContact CG-NH2 3.25Å; H90-R131 PolarHBondContact ND1-NH2 3.22Å
91	R	57.3	Low	54.8	Low	183 Å²	183	73.9 Å²	73.9	69%	0.691	38%	0.379	S	S	*	.			trans	-60.4	134.8	169.8	-174.9	173	172	-163.2	-1.3	109.7	S80 Q93	S80-R91 PolarHBondContact O-NH2 2.97Å; R91-Q93 PolarHBondContact O-N 3.49Å
92	P	58.3	Low	56.1	Low	30 Å²	30	70 Å²	70	20%	0.195	37%	0.369	C	S	.	.			trans	-66.4	134	-177.1	-9.2	26.3	0	0	0	109	I87 D96 I129	I87-P92 HydrophobicContact CD1-CG 3.59Å; P92-D96 WeakPolarHBondContact CA-OD2 3.43Å; P92-I129 HydrophobicContact CB-CD1 4.06Å; P92-I129 HydrophobicContact CG-CD1 4.34Å
93	Q	56.3	Low	57.1	Low	120 Å²	120	70.8 Å²	70.8	56%	0.561	39%	0.388	S	S	*	.			trans	-106.6	158	175	-60.6	-173.6	26.1	0	0	110.4	R91 G95 D96	R91-Q93 PolarHBondContact O-N 3.49Å; Q93-G95 PolarHBondContact O-N 3.32Å; Q93-D96 PolarHBondContact N-OD2 3.04Å; Q93-D96 WeakPolarHBondContact O-CB 3.06Å; Q93-D96 PolarHBondContact O-N 2.8Å; Q93-D96 VanDerWaalsContact O-N 3.15Å
94	V	55.6	Low	58.5	Low	97 Å²	97	71.5 Å²	71.5	59%	0.588	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	134.5	170.7	-178.6	0	0	0	0	107.7	E76 T78	E76-V94 WeakPolarHBondContact OE1-CG1 3.34Å; T78-V94 HydrophobicContact CG2-CG1 4.15Å; T78-V94 HydrophobicContact CG2-CG2 3.86Å
95	G	60.2	Low	59.9	Low	21 Å²	21	66.3 Å²	66.3	22%	0.216	37%	0.367	C	S	.	.	T	Hydrogen-bonded Turn	trans	94.1	-8.4	-171.2	0	0	0	0	0	115.9	E76 Q93 P132	E76-G95 PolarHBondContact OE1-N 3.17Å; Q93-G95 PolarHBondContact O-N 3.32Å; G95-P132 WeakPolarHBondContact O-CD 3.3Å; G95-P132 VanDerWaalsContact O-CG 3.26Å; G95-P132 WeakPolarHBondContact O-CG 3.45Å
96	D	64.7	Low	61.1	Low	15 Å²	15	65.9 Å²	65.9	8%	0.08	36%	0.362	C	S	.	.	P	Polyproline II helix	trans	-71.3	132.1	175.6	-81.6	-4.2	0	0	0	112.1	P92 Q93 I129 R131	P92-D96 WeakPolarHBondContact CA-OD2 3.43Å; Q93-D96 PolarHBondContact N-OD2 3.04Å; Q93-D96 WeakPolarHBondContact O-CB 3.06Å; Q93-D96 PolarHBondContact O-N 2.8Å; Q93-D96 VanDerWaalsContact O-N 3.15Å; D96-I129 HydrophobicContact CB-CG2 3.44Å; D96-I129 VanDerWaalsContact CB-CG2 3.44Å; D96-R131 WeakPolarHBondContact OD1-CG 3.16Å
97	L	67.1	Low	62.2	Low	19 Å²	19	67.8 Å²	67.8	10%	0.099	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	120.9	179.2	-59.4	174.2	0	0	0	110.5	D74 L99 I129 R130 P132	D74-L97 HydrophobicContact CB-CD2 4.04Å; L97-L99 PolarHBondContact O-N 3.29Å; L97-I129 CarbonylContact O-C 3.47Å; L97-I129 VanDerWaalsContact O-CA 3.25Å; L97-I129 WeakPolarHBondContact O-CA 3.34Å; L97-R130 HydrophobicContact CB-CB 4.4Å; L97-R130 WeakPolarHBondContact CB-O 3.49Å; L97-R130 PolarHBondContact N-O 3.4Å; L97-R130 PolarHBondContact O-N 2.84Å; L97-P132 HydrophobicContact CD1-CB 4.3Å; L97-P132 HydrophobicContact CD1-CG 4.11Å; L97-P132 HydrophobicContact CG-CG 4.12Å
98	V	68.3	Low	63	Low	12 Å²	12	67.2 Å²	67.2	7%	0.073	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	116.1	175.3	-174.6	0	0	0	0	109.8	V77 I101 T106 L127	V77-V98 HydrophobicContact CG2-CG2 3.67Å; V98-I101 HydrophobicContact CG1-CD1 4.5Å; V98-I101 HydrophobicContact CG1-CG1 3.82Å; V98-T106 HydrophobicContact CG1-CG2 3.95Å; V98-T106 PolarHBondContact O-OG1 2.78Å; V98-L127 HydrophobicContact CG1-CD2 4.1Å
99	L	67.9	Low	64.3	Low	62 Å²	62	62.2 Å²	62.2	33%	0.325	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	-36.2	178.3	-60.6	-176.8	0	0	0	113	L97 S105 T106 V128 R130	L97-L99 PolarHBondContact O-N 3.29Å; L99-S105 WeakPolarHBondContact O-CA 3.26Å; L99-T106 VanDerWaalsContact C-OG1 3.31Å; L99-T106 WeakPolarHBondContact CA-OG1 3.23Å; L99-T106 PolarHBondContact O-N 3.37Å; L99-T106 PolarHBondContact O-OG1 2.94Å; L99-V128 HydrophobicContact CB-CG1 4.38Å; L99-V128 PolarHBondContact N-O 3.2Å; L99-R130 HydrophobicContact CD1-CB 3.76Å; L99-R130 HydrophobicContact CD2-CB 4.36Å; L99-R130 HydrophobicContact CG-CB 4.01Å
100	H	72.6	Confident	65.2	Low	68 Å²	68	59.5 Å²	59.5	32%	0.315	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	142.8	177.9	-56.8	70.4	0	0	0	111.5	E104 L127 V128	H100-E104 CarbonylContact C-O 3.55Å; H100-E104 WeakPolarHBondContact CA-O 3.2Å; H100-L127 WeakPolarHBondContact O-CA 3.16Å; H100-V128 HydrophobicContact CB-CB 3.82Å; H100-V128 HydrophobicContact CB-CG2 3.85Å; H100-V128 PolarHBondContact N-O 3.34Å; H100-V128 PolarHBondContact O-N 3.1Å
101	I	74.7	Confident	65.8	Low	3 Å²	3	58.4 Å²	58.4	2%	0.015	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	118.3	173.2	-59.9	163.2	0	0	0	107.5	V98 G103 E104 T106 A114 R117 I118 L125 H126 L127	V98-I101 HydrophobicContact CG1-CD1 4.5Å; V98-I101 HydrophobicContact CG1-CG1 3.82Å; I101-G103 PolarHBondContact O-N 3.11Å; I101-G103 VanDerWaalsContact O-N 3.15Å; I101-E104 PolarHBondContact N-O 3.05Å; I101-E104 PolarHBondContact O-N 3.48Å; I101-T106 HydrophobicContact CD1-CG2 3.58Å; I101-T106 HydrophobicContact CG1-CG2 3.67Å; I101-A114 HydrophobicContact CD1-CB 4.02Å; I101-R117 HydrophobicContact CD1-CB 4.43Å; I101-R117 HydrophobicContact CG2-CB 3.99Å; I101-I118 HydrophobicContact CD1-CD1 4.17Å; I101-I118 HydrophobicContact CD1-CG1 3.97Å; I101-I118 HydrophobicContact CG1-CG1 4.39Å; I101-I118 HydrophobicContact CG2-CG1 3.98Å; I101-L125 HydrophobicContact CG2-CD1 3.85Å; I101-H126 CarbonylContact C-O 3.48Å; I101-L127 HydrophobicContact CB-CD2 4.23Å; I101-L127 HydrophobicContact CG1-CD2 3.83Å; I101-L127 HydrophobicContact CG2-CD2 4.17Å
102	N	70.2	Confident	66	Low	61 Å²	61	52.8 Å²	52.8	33%	0.326	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.6	31.8	-179.3	-61.4	-32.2	0	0	0	114.4	G121 L125 H126	N102-G121 VanDerWaalsContact ND2-CA 3.33Å; N102-G121 WeakPolarHBondContact ND2-CA 3.23Å; N102-L125 WeakPolarHBondContact OD1-CA 3.18Å; N102-H126 PolarHBondContact N-O 3.41Å; N102-H126 PolarHBondContact OD1-N 3.32Å
103	G	68.6	Low	66.5	Low	64 Å²	64	55.4 Å²	55.4	66%	0.66	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	89.5	-3.9	-177.6	0	0	0	0	0	114.7	I101	I101-G103 PolarHBondContact O-N 3.11Å; I101-G103 VanDerWaalsContact O-N 3.15Å
104	E	69.1	Low	67.2	Low	92 Å²	92	49.8 Å²	49.8	43%	0.43	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	134.9	178	-59.5	-176.4	129.5	0	0	111.5	H100 I101 R117	H100-E104 CarbonylContact C-O 3.55Å; H100-E104 WeakPolarHBondContact CA-O 3.2Å; I101-E104 PolarHBondContact N-O 3.05Å; I101-E104 PolarHBondContact O-N 3.48Å; E104-R117 VanDerWaalsContact CB-NH1 3.29Å; E104-R117 IonicContact OE1-CZ 3.9Å; E104-R117 IonicContact OE1-NH1 3.98Å; E104-R117 WeakPolarHBondContact OE2-CD 3.44Å; E104-R117 IonicContact OE2-CZ 3.96Å; E104-R117 IonicContact OE2-NE 2.97Å; E104-R117 PolarHBondContact OE2-NE 2.82Å; E104-R117 IonicContact OE2-NH1 3.98Å; E104-R117 PolarHBondContact OE2-NH1 3.29Å; E104-R117 IonicContact OE2-NH2 3.57Å
105	S	69.1	Low	67.9	Low	49 Å²	49	46.7 Å²	46.7	34%	0.343	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.1	139.1	177.9	-177.7	0	0	0	0	111.3	L99 Q107	L99-S105 WeakPolarHBondContact O-CA 3.26Å; S105-Q107 VanDerWaalsContact C-N 3.26Å; S105-Q107 WeakPolarHBondContact OG-CB 3.46Å; S105-Q107 PolarHBondContact OG-N 3.04Å; S105-Q107 VanDerWaalsContact OG-N 3.1Å
106	T	70.1	Confident	68.4	Low	10 Å²	10	52 Å²	52	6%	0.061	30%	0.3	C	S	.	.			trans	-82.5	-6	171.2	56.3	0	0	0	0	112.7	V98 L99 I101 G108 L109	V98-T106 HydrophobicContact CG1-CG2 3.95Å; V98-T106 PolarHBondContact O-OG1 2.78Å; L99-T106 VanDerWaalsContact C-OG1 3.31Å; L99-T106 WeakPolarHBondContact CA-OG1 3.23Å; L99-T106 PolarHBondContact O-N 3.37Å; L99-T106 PolarHBondContact O-OG1 2.94Å; I101-T106 HydrophobicContact CD1-CG2 3.58Å; I101-T106 HydrophobicContact CG1-CG2 3.67Å; T106-G108 PolarHBondContact O-N 3.3Å; T106-L109 WeakPolarHBondContact O-CB 3.48Å; T106-L109 PolarHBondContact O-N 2.93Å; T106-L109 VanDerWaalsContact O-N 3.11Å
107	Q	67.8	Low	68.7	Low	117 Å²	117	54.9 Å²	54.9	55%	0.547	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62	127.6	178.5	-165.2	176.5	-9.6	0	0	110.7	D71 S105 L109	D71-Q107 WeakPolarHBondContact O-CG 3.44Å; D71-Q107 PolarHBondContact O-NE2 2.89Å; S105-Q107 VanDerWaalsContact C-N 3.26Å; S105-Q107 WeakPolarHBondContact OG-CB 3.46Å; S105-Q107 PolarHBondContact OG-N 3.04Å; S105-Q107 VanDerWaalsContact OG-N 3.1Å; Q107-L109 PolarHBondContact O-N 2.74Å
108	G	64.6	Low	69	Low	33 Å²	33	55.4 Å²	55.4	34%	0.34	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.1	0.4	-176.8	0	0	0	0	0	115.4	D71 T106	D71-G108 WeakPolarHBondContact OD2-CA 3.3Å; T106-G108 PolarHBondContact O-N 3.3Å
109	L	68.4	Low	68.9	Low	17 Å²	17	62 Å²	62	9%	0.089	34%	0.336	C	S	.	.			trans	-77.2	135.1	174.5	-63.2	-172.4	0	0	0	111	A73 T106 Q107 Q113 R117	A73-L109 WeakPolarHBondContact CB-O 3.42Å; T106-L109 WeakPolarHBondContact O-CB 3.48Å; T106-L109 PolarHBondContact O-N 2.93Å; T106-L109 VanDerWaalsContact O-N 3.11Å; Q107-L109 PolarHBondContact O-N 2.74Å; L109-Q113 HydrophobicContact CB-CB 4.44Å; L109-Q113 HydrophobicContact CD2-CB 4.42Å; L109-R117 HydrophobicContact CD1-CG 4.43Å
110	T	68.3	Low	68.9	Low	78 Å²	78	63 Å²	63	48%	0.479	35%	0.353	S	S	.	.			trans	-68.5	154.7	165.8	65.7	0	0	0	0	110.2	A112 Q113 A114	T110-A112 PolarHBondContact O-N 3.42Å; T110-A112 VanDerWaalsContact O-N 3.17Å; T110-Q113 PolarHBondContact O-N 3.02Å; T110-Q113 VanDerWaalsContact OG1-CD 3.26Å; T110-Q113 VanDerWaalsContact OG1-CG 3.26Å; T110-Q113 WeakPolarHBondContact OG1-CG 3.24Å; T110-Q113 PolarHBondContact OG1-N 3.25Å; T110-Q113 PolarHBondContact OG1-OE1 3.35Å; T110-A114 PolarHBondContact O-N 2.74Å
111	H	63.3	Low	68.4	Low	75 Å²	75	60.8 Å²	60.8	35%	0.347	35%	0.348	S	S	.	.	H	α-helix	trans	-49.7	-41.9	174.2	166.8	90.6	0	0	0	112.7	L61 A114 V115	L61-H111 WeakPolarHBondContact CB-CE1 3.33Å; L61-H111 PolarHBondContact O-CE1 3.14Å; H111-A114 PolarHBondContact O-N 3.49Å; H111-V115 WeakPolarHBondContact O-CG2 3.3Å; H111-V115 PolarHBondContact O-N 3.17Å
112	A	61.5	Low	67.8	Low	65 Å²	65	63.1 Å²	63.1	54%	0.537	37%	0.374	S	S	.	.	H	α-helix	trans	-66.1	-41.8	178.9	0	0	0	0	0	112.3	T110 V115 E116	T110-A112 PolarHBondContact O-N 3.42Å; T110-A112 VanDerWaalsContact O-N 3.17Å; A112-V115 WeakPolarHBondContact O-CB 3.2Å; A112-V115 PolarHBondContact O-N 3.42Å; A112-E116 PolarHBondContact O-N 3.01Å
113	Q	68.6	Low	66.9	Low	85 Å²	85	66 Å²	66	40%	0.397	40%	0.396	S	S	.	.	H	α-helix	trans	-66.3	-40.4	177.5	-72.6	165	-43.3	0	0	111.8	L109 T110 V115 E116 R117	L109-Q113 HydrophobicContact CB-CB 4.44Å; L109-Q113 HydrophobicContact CD2-CB 4.42Å; T110-Q113 PolarHBondContact O-N 3.02Å; T110-Q113 VanDerWaalsContact OG1-CD 3.26Å; T110-Q113 VanDerWaalsContact OG1-CG 3.26Å; T110-Q113 WeakPolarHBondContact OG1-CG 3.24Å; T110-Q113 PolarHBondContact OG1-N 3.25Å; T110-Q113 PolarHBondContact OG1-OE1 3.35Å; Q113-V115 VanDerWaalsContact C-N 3.33Å; Q113-V115 PolarHBondContact O-N 3.02Å; Q113-E116 WeakPolarHBondContact O-CB 3.38Å; Q113-E116 PolarHBondContact O-N 3.49Å; Q113-R117 WeakPolarHBondContact O-CG 3.49Å; Q113-R117 PolarHBondContact O-N 2.81Å
114	A	69.9	Low	66	Low	2 Å²	2	69.1 Å²	69.1	2%	0.017	39%	0.393	C	S	.	.	H	α-helix	trans	-62.7	-40.5	174.7	0	0	0	0	0	111.9	I75 I101 T110 H111 E116 R117 I118	I75-A114 HydrophobicContact CD1-CB 3.32Å; I101-A114 HydrophobicContact CD1-CB 4.02Å; T110-A114 PolarHBondContact O-N 2.74Å; H111-A114 PolarHBondContact O-N 3.49Å; A114-E116 VanDerWaalsContact C-N 3.33Å; A114-E116 PolarHBondContact O-N 3.36Å; A114-R117 PolarHBondContact O-N 3.29Å; A114-I118 VanDerWaalsContact O-CG1 3.3Å; A114-I118 WeakPolarHBondContact O-CG1 3.25Å; A114-I118 PolarHBondContact O-N 2.77Å
115	V	70.4	Confident	65.8	Low	33 Å²	33	65.7 Å²	65.7	20%	0.2	38%	0.377	C	S	.	.	H	α-helix	trans	-60.4	-44.1	173.1	170.6	0	0	0	0	111	L61 H111 A112 Q113 R117 I118 R119	L61-V115 HydrophobicContact CD1-CG2 3.5Å; L61-V115 VanDerWaalsContact CD1-CG2 3.5Å; H111-V115 WeakPolarHBondContact O-CG2 3.3Å; H111-V115 PolarHBondContact O-N 3.17Å; A112-V115 WeakPolarHBondContact O-CB 3.2Å; A112-V115 PolarHBondContact O-N 3.42Å; Q113-V115 VanDerWaalsContact C-N 3.33Å; Q113-V115 PolarHBondContact O-N 3.02Å; V115-R117 VanDerWaalsContact C-N 3.35Å; V115-I118 PolarHBondContact O-N 3.28Å; V115-R119 HydrophobicContact CG1-CG 4.35Å; V115-R119 VanDerWaalsContact CG1-NE 3.26Å; V115-R119 WeakPolarHBondContact O-CB 3.43Å; V115-R119 VanDerWaalsContact O-CG 3.23Å; V115-R119 WeakPolarHBondContact O-CG 3.26Å; V115-R119 PolarHBondContact O-N 3.12Å
116	E	71.9	Confident	65.6	Low	132 Å²	132	68.1 Å²	68.1	62%	0.617	38%	0.383	S	S	*	.	H	α-helix	trans	-62.4	-42.2	178.7	-170.8	178	-175.9	0	0	111.6	A112 Q113 A114 I118 R119 A120	A112-E116 PolarHBondContact O-N 3.01Å; Q113-E116 WeakPolarHBondContact O-CB 3.38Å; Q113-E116 PolarHBondContact O-N 3.49Å; A114-E116 VanDerWaalsContact C-N 3.33Å; A114-E116 PolarHBondContact O-N 3.36Å; E116-I118 PolarHBondContact O-N 3.41Å; E116-R119 CarbonylContact O-C 3.6Å; E116-R119 WeakPolarHBondContact O-CB 3.44Å; E116-R119 PolarHBondContact O-N 2.99Å; E116-R119 VanDerWaalsContact O-N 3.15Å; E116-A120 VanDerWaalsContact O-CB 3.26Å; E116-A120 WeakPolarHBondContact O-CB 3.27Å; E116-A120 PolarHBondContact O-N 3.01Å
117	R	70.8	Confident	65.7	Low	75 Å²	75	68.7 Å²	68.7	28%	0.283	39%	0.386	S	S	.	.	H	α-helix	trans	-62.3	-41.5	176.6	-64	-94.2	-175.2	98.9	1.2	112.3	I101 E104 L109 Q113 A114 V115 R119 A120 G121	I101-R117 HydrophobicContact CD1-CB 4.43Å; I101-R117 HydrophobicContact CG2-CB 3.99Å; E104-R117 VanDerWaalsContact CB-NH1 3.29Å; E104-R117 IonicContact OE1-CZ 3.9Å; E104-R117 IonicContact OE1-NH1 3.98Å; E104-R117 WeakPolarHBondContact OE2-CD 3.44Å; E104-R117 IonicContact OE2-CZ 3.96Å; E104-R117 IonicContact OE2-NE 2.97Å; E104-R117 PolarHBondContact OE2-NE 2.82Å; E104-R117 IonicContact OE2-NH1 3.98Å; E104-R117 PolarHBondContact OE2-NH1 3.29Å; E104-R117 IonicContact OE2-NH2 3.57Å; L109-R117 HydrophobicContact CD1-CG 4.43Å; Q113-R117 WeakPolarHBondContact O-CG 3.49Å; Q113-R117 PolarHBondContact O-N 2.81Å; A114-R117 PolarHBondContact O-N 3.29Å; V115-R117 VanDerWaalsContact C-N 3.35Å; R117-R119 VanDerWaalsContact C-N 3.35Å; R117-A120 PolarHBondContact O-N 2.87Å; R117-G121 PolarHBondContact O-N 3.09Å; R117-G121 VanDerWaalsContact O-N 3.11Å
118	I	71.9	Confident	65.8	Low	31 Å²	31	66.8 Å²	66.8	16%	0.159	38%	0.382	C	S	.	.	H	α-helix	trans	-64.8	-41.6	174.2	-67.7	165.6	0	0	0	110.5	L61 I101 A114 V115 E116 G121 L125	L61-I118 HydrophobicContact CD1-CD1 4.17Å; I101-I118 HydrophobicContact CD1-CD1 4.17Å; I101-I118 HydrophobicContact CD1-CG1 3.97Å; I101-I118 HydrophobicContact CG1-CG1 4.39Å; I101-I118 HydrophobicContact CG2-CG1 3.98Å; A114-I118 VanDerWaalsContact O-CG1 3.3Å; A114-I118 WeakPolarHBondContact O-CG1 3.25Å; A114-I118 PolarHBondContact O-N 2.77Å; V115-I118 PolarHBondContact O-N 3.28Å; E116-I118 PolarHBondContact O-N 3.41Å; I118-G121 PolarHBondContact O-N 2.87Å; I118-L125 HydrophobicContact CB-CD1 4.41Å; I118-L125 HydrophobicContact CG1-CD1 4.32Å; I118-L125 HydrophobicContact CG1-CD2 4.39Å; I118-L125 HydrophobicContact CG2-CD1 4.36Å; I118-L125 HydrophobicContact CG2-CD2 3.89Å
119	R	68	Low	66.2	Low	150 Å²	150	67.4 Å²	67.4	57%	0.566	38%	0.377	S	S	*	.	H	α-helix	trans	-67.8	-37.9	177.5	-73.2	170.2	178	-103.9	1.1	112.5	V115 E116 R117 G121	V115-R119 HydrophobicContact CG1-CG 4.35Å; V115-R119 VanDerWaalsContact CG1-NE 3.26Å; V115-R119 WeakPolarHBondContact O-CB 3.43Å; V115-R119 VanDerWaalsContact O-CG 3.23Å; V115-R119 WeakPolarHBondContact O-CG 3.26Å; V115-R119 PolarHBondContact O-N 3.12Å; E116-R119 CarbonylContact O-C 3.6Å; E116-R119 WeakPolarHBondContact O-CB 3.44Å; E116-R119 PolarHBondContact O-N 2.99Å; E116-R119 VanDerWaalsContact O-N 3.15Å; R117-R119 VanDerWaalsContact C-N 3.35Å; R119-G121 VanDerWaalsContact C-N 3.31Å
120	A	66.8	Low	66.3	Low	83 Å²	83	74.1 Å²	74.1	69%	0.686	40%	0.401	S	S	*	.	H	α-helix	trans	-72.2	-24.1	179.7	0	0	0	0	0	112.6	E116 R117 G122	E116-A120 VanDerWaalsContact O-CB 3.26Å; E116-A120 WeakPolarHBondContact O-CB 3.27Å; E116-A120 PolarHBondContact O-N 3.01Å; R117-A120 PolarHBondContact O-N 2.87Å; A120-G122 PolarHBondContact O-N 3.27Å; A120-G122 VanDerWaalsContact O-N 3.11Å
121	G	61.7	Low	66.3	Low	21 Å²	21	76.8 Å²	76.8	22%	0.216	40%	0.403	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-11.1	177.6	0	0	0	0	0	115.6	N102 R117 I118 R119	N102-G121 VanDerWaalsContact ND2-CA 3.33Å; N102-G121 WeakPolarHBondContact ND2-CA 3.23Å; R117-G121 PolarHBondContact O-N 3.09Å; R117-G121 VanDerWaalsContact O-N 3.11Å; I118-G121 PolarHBondContact O-N 2.87Å; R119-G121 VanDerWaalsContact C-N 3.31Å
122	G	61.7	Low	66.1	Low	53 Å²	53	75.6 Å²	75.6	55%	0.546	40%	0.401	S	S	.	.	T	Hydrogen-bonded Turn	trans	62.4	-138.1	178.1	0	0	0	0	0	112.1	A120	A120-G122 PolarHBondContact O-N 3.27Å; A120-G122 VanDerWaalsContact O-N 3.11Å
123	P	52.9	Low	65.7	Low	122 Å²	122	80.3 Å²	80.3	79%	0.792	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.6	-9.9	-173.6	32.4	-35	0	0	0	114.8
124	Q	49.4	Very low	64.7	Low	128 Å²	128	83.4 Å²	83.4	60%	0.598	43%	0.431	S	S	*	.			trans	-124.5	121.7	-179.6	-73	-179	-3.6	0	0	109.9
125	L	65.1	Low	63.6	Low	20 Å²	20	89.3 Å²	89.3	11%	0.105	47%	0.467	C	S	.	.	B	Isolated β-bridge	trans	-122.5	116.8	-178.7	-170.8	70.7	0	0	0	109.5	I101 N102 I118 L127	I101-L125 HydrophobicContact CG2-CD1 3.85Å; N102-L125 WeakPolarHBondContact OD1-CA 3.18Å; I118-L125 HydrophobicContact CB-CD1 4.41Å; I118-L125 HydrophobicContact CG1-CD1 4.32Å; I118-L125 HydrophobicContact CG1-CD2 4.39Å; I118-L125 HydrophobicContact CG2-CD1 4.36Å; I118-L125 HydrophobicContact CG2-CD2 3.89Å; L125-L127 HydrophobicContact CD1-CD2 4.17Å; L125-L127 HydrophobicContact CD2-CD1 3.81Å; L125-L127 HydrophobicContact CD2-CD2 3.81Å; L125-L127 HydrophobicContact CD2-CG 3.84Å; L125-L127 HydrophobicContact CG-CD1 4.38Å; L125-L127 HydrophobicContact CG-CD2 3.73Å; L125-L127 HydrophobicContact CG-CG 3.86Å
126	H	63.5	Low	62.3	Low	101 Å²	101	95.5 Å²	95.5	47%	0.468	49%	0.494	S	S	.	.			trans	-96.5	109	173.7	-67.1	156.6	0	0	0	109.7	T86 I101 N102	T86-H126 PolarHBondContact OG1-CD2 3.21Å; T86-H126 PolarHBondContact OG1-NE2 3.46Å; T86-H126 VanDerWaalsContact OG1-NE2 3.17Å; I101-H126 CarbonylContact C-O 3.48Å; N102-H126 PolarHBondContact N-O 3.41Å; N102-H126 PolarHBondContact OD1-N 3.32Å
127	L	72.4	Confident	60.9	Low	21 Å²	21	95.5 Å²	95.5	11%	0.11	51%	0.505	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	127.4	178.3	-59.5	-178.8	0	0	0	110.1	V98 H100 I101 L125 I129	V98-L127 HydrophobicContact CG1-CD2 4.1Å; H100-L127 WeakPolarHBondContact O-CA 3.16Å; I101-L127 HydrophobicContact CB-CD2 4.23Å; I101-L127 HydrophobicContact CG1-CD2 3.83Å; I101-L127 HydrophobicContact CG2-CD2 4.17Å; L125-L127 HydrophobicContact CD1-CD2 4.17Å; L125-L127 HydrophobicContact CD2-CD1 3.81Å; L125-L127 HydrophobicContact CD2-CD2 3.81Å; L125-L127 HydrophobicContact CD2-CG 3.84Å; L125-L127 HydrophobicContact CG-CD1 4.38Å; L125-L127 HydrophobicContact CG-CD2 3.73Å; L125-L127 HydrophobicContact CG-CG 3.86Å; L127-I129 HydrophobicContact CB-CD1 4.33Å; L127-I129 HydrophobicContact CB-CG1 4.18Å
128	V	69.6	Low	59.3	Low	77 Å²	77	94.8 Å²	94.8	47%	0.467	52%	0.521	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	119.7	166.8	-179.7	0	0	0	0	107.5	L99 H100	L99-V128 HydrophobicContact CB-CG1 4.38Å; L99-V128 PolarHBondContact N-O 3.2Å; H100-V128 HydrophobicContact CB-CB 3.82Å; H100-V128 HydrophobicContact CB-CG2 3.85Å; H100-V128 PolarHBondContact N-O 3.34Å; H100-V128 PolarHBondContact O-N 3.1Å
129	I	74.3	Confident	58.1	Low	47 Å²	47	102.9 Å²	102.9	24%	0.241	56%	0.555	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-118	139.6	-172.3	-63.3	174.2	0	0	0	110	P92 D96 L97 L127	P92-I129 HydrophobicContact CB-CD1 4.06Å; P92-I129 HydrophobicContact CG-CD1 4.34Å; D96-I129 HydrophobicContact CB-CG2 3.44Å; D96-I129 VanDerWaalsContact CB-CG2 3.44Å; L97-I129 CarbonylContact O-C 3.47Å; L97-I129 VanDerWaalsContact O-CA 3.25Å; L97-I129 WeakPolarHBondContact O-CA 3.34Å; L127-I129 HydrophobicContact CB-CD1 4.33Å; L127-I129 HydrophobicContact CB-CG1 4.18Å
130	R	69.6	Low	56.9	Low	158 Å²	158	101.5 Å²	101.5	60%	0.596	57%	0.565	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-109	126.2	166.7	177	178.3	174.9	-171	-1.5	109.3	L97 L99 P132	L97-R130 HydrophobicContact CB-CB 4.4Å; L97-R130 WeakPolarHBondContact CB-O 3.49Å; L97-R130 PolarHBondContact N-O 3.4Å; L97-R130 PolarHBondContact O-N 2.84Å; L99-R130 HydrophobicContact CD1-CB 3.76Å; L99-R130 HydrophobicContact CD2-CB 4.36Å; L99-R130 HydrophobicContact CG-CB 4.01Å; R130-P132 WeakPolarHBondContact O-CD 3.28Å
131	R	69.8	Low	56	Low	134 Å²	134	109.2 Å²	109.2	51%	0.506	58%	0.576	S	S	.	*			trans	-80.7	110.3	165.8	-88.9	179.5	-83.3	-167.1	-3	108.9	H90 D96 L133	H90-R131 PolarHBondContact CD2-NH2 3.22Å; H90-R131 VanDerWaalsContact CG-NH2 3.25Å; H90-R131 PolarHBondContact ND1-NH2 3.22Å; D96-R131 WeakPolarHBondContact OD1-CG 3.16Å; R131-L133 PolarHBondContact O-N 3.39Å
132	P	59	Low	54.7	Low	49 Å²	49	111.5 Å²	111.5	32%	0.318	60%	0.6	S	S	.	*			trans	-65.5	129.1	164.7	26.4	-27.9	0	0	0	107.6	G95 L97 R130 E134	G95-P132 WeakPolarHBondContact O-CD 3.3Å; G95-P132 VanDerWaalsContact O-CG 3.26Å; G95-P132 WeakPolarHBondContact O-CG 3.45Å; L97-P132 HydrophobicContact CD1-CB 4.3Å; L97-P132 HydrophobicContact CD1-CG 4.11Å; L97-P132 HydrophobicContact CG-CG 4.12Å; R130-P132 WeakPolarHBondContact O-CD 3.28Å; P132-E134 PolarHBondContact O-N 3.25Å
133	L	51.9	Low	53.9	Low	165 Å²	165	115.6 Å²	115.6	86%	0.864	61%	0.614	S	S	*	*			trans	-63.5	99.7	174.6	-177.5	69	0	0	0	107.7	R131 T135	R131-L133 PolarHBondContact O-N 3.39Å; L133-T135 PolarHBondContact O-N 3.42Å
134	E	48.7	Very low	53.2	Low	150 Å²	150	112.7 Å²	112.7	70%	0.701	61%	0.607	S	S	*	*			trans	-66.2	100.7	168.2	-69.5	-167.7	121	0	0	107.8	P132 H136	P132-E134 PolarHBondContact O-N 3.25Å; E134-H136 VanDerWaalsContact C-N 3.31Å; E134-H136 PolarHBondContact O-N 2.79Å
135	T	45.6	Very low	52.6	Low	125 Å²	125	115.6 Å²	115.6	77%	0.767	62%	0.62	S	S	*	*			trans	-56.3	101.9	156.2	-48	0	0	0	0	106.7	L133 P137	L133-T135 PolarHBondContact O-N 3.42Å; T135-P137 WeakPolarHBondContact O-CD 3.43Å
136	H	43.2	Very low	52.2	Low	164 Å²	164	119 Å²	119	76%	0.759	64%	0.643	S	S	*	*			trans	-45.5	124.7	174	-64.3	-76.5	0	0	0	110.4	E134 G138	E134-H136 VanDerWaalsContact C-N 3.31Å; E134-H136 PolarHBondContact O-N 2.79Å; H136-G138 PolarHBondContact O-N 3.47Å
137	P	43.3	Very low	50.9	Low	132 Å²	132	125.5 Å²	125.5	86%	0.857	66%	0.664	S	S	*	*			trans	-71	92.2	150.5	29.3	-26.2	0	0	0	104.9	T135 K139	T135-P137 WeakPolarHBondContact O-CD 3.43Å; P137-K139 PolarHBondContact O-N 2.98Å; P137-K139 VanDerWaalsContact O-N 3.15Å
138	G	37	Very low	49.5	Very low	59 Å²	59	134.6 Å²	134.6	61%	0.608	70%	0.702	S	S	*	*			trans	-49.7	122.3	178.8	0	0	0	0	0	109.9	H136 P140	H136-G138 PolarHBondContact O-N 3.47Å; G138-P140 WeakPolarHBondContact O-CD 3.23Å
139	K	46.2	Very low	48	Very low	202 Å²	202	134.3 Å²	134.3	88%	0.878	72%	0.715	S	S	*	*			trans	-65.6	112.9	152.3	-112.4	162.9	173.3	174.3	0	105.6	P137 R141	P137-K139 PolarHBondContact O-N 2.98Å; P137-K139 VanDerWaalsContact O-N 3.15Å; K139-R141 PolarHBondContact O-N 2.9Å; K139-R141 VanDerWaalsContact O-N 3.13Å
140	P	42.8	Very low	46.1	Very low	120 Å²	120	139.1 Å²	139.1	78%	0.779	75%	0.746	S	S	*	*			trans	-71.9	115.6	165.3	30.8	-27.4	0	0	0	105.6	G138 G142	G138-P140 WeakPolarHBondContact O-CD 3.23Å; P140-G142 PolarHBondContact O-N 3.42Å
141	R	47.6	Very low	44.7	Very low	246 Å²	246	137.8 Å²	137.8	93%	0.928	76%	0.755	S	S	*	*			trans	-65.2	85.4	158.3	-177.3	164.8	-121.3	-98.2	-3.2	106.5	K139	K139-R141 PolarHBondContact O-N 2.9Å; K139-R141 VanDerWaalsContact O-N 3.13Å
142	G	36.1	Very low	43.8	Very low	69 Å²	69	136.9 Å²	136.9	71%	0.711	77%	0.767	S	S	*	*			trans	-90	102.1	177.8	0	0	0	0	0	110.2	P140	P140-G142 PolarHBondContact O-N 3.42Å
143	V	44.1	Very low	42.5	Very low	138 Å²	138	139.5 Å²	139.5	84%	0.836	79%	0.786	S	S	*	*			trans	-50.9	143.7	158.1	173.6	0	0	0	0	108.9
144	G	37.8	Very low	41.9	Very low	62 Å²	62	143.8 Å²	143.8	64%	0.639	79%	0.791	S	S	*	*	S	Bend	trans	-58.7	154	-178.3	0	0	0	0	0	114.4
145	E	36.5	Very low	41.7	Very low	189 Å²	189	142.1 Å²	142.1	88%	0.883	79%	0.793	S	S	*	*			trans	83.2	156.1	142.9	-96.7	-151.5	111	0	0	119.5
146	P	56.6	Low	41.2	Very low	91 Å²	91	142.9 Å²	142.9	59%	0.591	79%	0.793	S	S	*	*				-122.6	170.9	-119.2	36.1	-18.6	0	0	0	111.8
147	R	37.4	Very low	40.6	Very low	238 Å²	238	146 Å²	146	90%	0.898	80%	0.798	S	S	*	*			trans	169.3	125.4	138.7	-92.2	149.9	160	-113.6	-9.7	114.8
148	K	42.2	Very low	40.5	Very low	211 Å²	211	144.8 Å²	144.8	92%	0.917	79%	0.792	S	S	*	*			trans	14.1	126.9	140.9	-63.8	-173.5	176.4	-173.3	0	119.8
149	G	38.5	Very low	41	Very low	71 Å²	71	148 Å²	148	73%	0.732	80%	0.802	S	S	*	*				113.7	137.5	115.1	0	0	0	0	0	118.1
150	V	33.8	Very low	40.8	Very low	148 Å²	148	144.6 Å²	144.6	90%	0.897	79%	0.794	S	S	*	*			trans	96.2	100.7	154.4	-165	0	0	0	0	117.5
151	V	40.5	Very low	41	Very low	130 Å²	130	144.9 Å²	144.9	79%	0.788	80%	0.796	S	S	*	*			trans	-76.8	158.5	148.5	157.5	0	0	0	0	108
152	P	50.3	Low	40.4	Very low	116 Å²	116	136.1 Å²	136.1	75%	0.753	78%	0.782	S	S	*	*			cis	-135.8	177.4	16.7	23	3	0	0	0	115.3
153	S	33.2	Very low	40.2	Very low	104 Å²	104	136.3 Å²	136.3	73%	0.727	78%	0.783	S	S	*	*				171	113	124.8	-166	0	0	0	0	111.3
154	W	38.1	Very low	40.5	Very low	255 Å²	255	135.5 Å²	135.5	97%	0.966	78%	0.781	S	S	*	*			trans	-110.2	132.4	161.6	-75.1	46.6	0	0	0	107.2
155	P	44.8	Very low	40.3	Very low	114 Å²	114	141.1 Å²	141.1	74%	0.74	79%	0.791	S	S	*	*			trans	-110.4	111.5	148.3	27.7	-13.6	0	0	0	108.1
156	D	34.5	Very low	40.3	Very low	141 Å²	141	138 Å²	138	75%	0.754	79%	0.785	S	S	*	*				60.5	94.4	92.8	-168.7	38	0	0	0	114.1
157	R	31.5	Very low	39.3	Very low	231 Å²	231	139.9 Å²	139.9	87%	0.872	79%	0.794	S	S	*	*				-176.6	104.6	124.5	-108	-178.1	-170.5	-176.8	2.8	111.1
158	S	40.2	Very low	38.9	Very low	106 Å²	106	131.6 Å²	131.6	74%	0.741	78%	0.783	S	S	*	*			trans	-73.9	160.9	141.9	-69.6	0	0	0	0	108.9
159	P	47.9	Very low	38.4	Very low	125 Å²	125	126.7 Å²	126.7	81%	0.812	78%	0.776	S	S	*	*				-132.8	126.7	105.5	28.9	-14.6	0	0	0	112.6
160	D	42.3	Very low	38.1	Very low	132 Å²	132	134 Å²	134	71%	0.706	78%	0.781	S	S	*	*			trans	-61.5	158.1	148.7	-176.9	-111	0	0	0	110	G162	D160-G162 VanDerWaalsContact CG-N 3.32Å; D160-G162 PolarHBondContact OD1-N 2.97Å
161	P	47.2	Very low	38.1	Very low	126 Å²	126	131.7 Å²	131.7	82%	0.818	77%	0.771	S	S	*	*				-136.7	110.2	125.5	33.7	-20.5	0	0	0	112
162	G	35.3	Very low	37.7	Very low	61 Å²	61	130.5 Å²	130.5	63%	0.629	77%	0.769	S	S	*	*			trans	-85.6	154.3	151.5	0	0	0	0	0	110.8	D160	D160-G162 VanDerWaalsContact CG-N 3.32Å; D160-G162 PolarHBondContact OD1-N 2.97Å
163	G	31.3	Very low	36.9	Very low	73 Å²	73	130.1 Å²	130.1	75%	0.753	77%	0.769	S	S	*	*			trans	145.7	150.1	154	0	0	0	0	0	116
164	P	50.5	Low	37	Very low	122 Å²	122	130.8 Å²	130.8	79%	0.792	77%	0.769	S	S	*	*				-130.2	175.7	-129.8	39	-21.3	0	0	0	115.3
165	E	33.5	Very low	36.7	Very low	180 Å²	180	123.7 Å²	123.7	84%	0.841	76%	0.758	S	S	*	*			trans	58.2	124.4	155.1	-60.7	-138.5	90	0	0	121.4
166	V	35.6	Very low	36.2	Very low	124 Å²	124	126.2 Å²	126.2	75%	0.752	77%	0.765	S	S	*	*				146.2	146.2	104.3	81.3	0	0	0	0	113.4
167	T	35.8	Very low	36.3	Very low	129 Å²	129	125.3 Å²	125.3	79%	0.791	76%	0.764	S	S	*	*			trans	92.5	125.1	164.7	78.1	0	0	0	0	118.8
168	G	29.9	Very low	36.5	Very low	65 Å²	65	123.1 Å²	123.1	67%	0.67	76%	0.764	S	S	*	*				106.3	99.5	122.4	0	0	0	0	0	117.4
169	S	31.6	Very low	36.3	Very low	108 Å²	108	126.7 Å²	126.7	76%	0.755	77%	0.768	S	S	*	*			trans	77.3	118	132.9	-66.2	0	0	0	0	120.5
170	R	32	Very low	36.6	Very low	224 Å²	224	125.6 Å²	125.6	85%	0.845	76%	0.761	S	S	*	*				81.9	114.7	123.4	-67.9	173.4	126.1	-145.9	-2.7	118.8
171	S	33.7	Very low	36.7	Very low	99 Å²	99	125 Å²	125	69%	0.692	77%	0.765	S	S	*	*				81.5	120.8	120.9	-67.9	0	0	0	0	119.9
172	S	32.8	Very low	36	Very low	106 Å²	106	123.8 Å²	123.8	74%	0.741	76%	0.759	S	S	*	*				74.4	108.9	125.2	-50.5	0	0	0	0	119.5
173	S	33.8	Very low	35.9	Very low	108 Å²	108	132.2 Å²	132.2	76%	0.755	77%	0.772	S	S	*	*				57.9	145.3	113.6	-140	0	0	0	0	121.3
174	T	34.8	Very low	35.9	Very low	117 Å²	117	134.3 Å²	134.3	72%	0.718	77%	0.77	S	S	*	*			trans	87.7	115.5	154.4	71.5	0	0	0	0	120
175	S	32.2	Very low	35.2	Very low	107 Å²	107	135 Å²	135	75%	0.748	77%	0.772	S	S	*	*				41.8	123.1	122.3	-51.4	0	0	0	0	120.3
176	L	33.9	Very low	35.4	Very low	166 Å²	166	133.8 Å²	133.8	87%	0.869	77%	0.771	S	S	*	*			trans	-157.5	93.4	153.5	-96.7	152.5	0	0	0	106.9
177	V	35.7	Very low	35.5	Very low	122 Å²	122	137.4 Å²	137.4	74%	0.739	78%	0.776	S	S	*	*				45.3	100.2	84.1	-177	0	0	0	0	112
178	Q	37	Very low	35.3	Very low	186 Å²	186	140.3 Å²	140.3	87%	0.869	78%	0.778	S	S	*	*			trans	-136.8	101.7	155.8	-77.5	-162.9	87.2	0	0	111.1
179	H	34.6	Very low	35.5	Very low	181 Å²	181	143.6 Å²	143.6	84%	0.838	79%	0.785	S	S	*	*			trans	-152.2	161.5	152.4	-82.1	-62.5	0	0	0	105.5
180	P	55.8	Low	35.5	Very low	101 Å²	101	150.1 Å²	150.1	66%	0.656	79%	0.793	S	S	*	*			cis	-136.3	-158.2	-17	35.6	-12	0	0	0	111.2
181	P	43.7	Very low	35.3	Very low	121 Å²	121	143.1 Å²	143.1	79%	0.786	79%	0.79	S	S	*	*				-140.3	136.9	78.2	30	-9.5	0	0	0	113.6
182	S	32.2	Very low	35.2	Very low	99 Å²	99	144.1 Å²	144.1	69%	0.692	80%	0.797	S	S	*	*				97.6	137.9	71.9	-61.5	0	0	0	0	115.2
183	R	32.8	Very low	35.8	Very low	238 Å²	238	144.5 Å²	144.5	90%	0.898	80%	0.797	S	S	*	*			trans	96.6	119.9	171.7	-54.6	176.4	82.1	-178.6	4	112.7
184	T	32.6	Very low	36	Very low	118 Å²	118	146.9 Å²	146.9	72%	0.724	80%	0.797	S	S	*	*			cis	-158	144.9	41.1	40.5	0	0	0	0	114.4
185	T	35.6	Very low	36.3	Very low	136 Å²	136	147.1 Å²	147.1	83%	0.834	80%	0.8	S	S	*	*			trans	73.1	116.1	147.6	56.3	0	0	0	0	122.8
186	L	37.4	Very low	36.3	Very low	154 Å²	154	146.4 Å²	146.4	81%	0.806	80%	0.795	S	S	*	*			trans	-100.1	139.2	174.3	-174.1	84.1	0	0	0	111.5
187	K	37.3	Very low	37.1	Very low	201 Å²	201	143.7 Å²	143.7	87%	0.874	79%	0.787	S	S	*	*			trans	-155.2	91	146.5	-33.2	-88.3	176.9	174.6	0	107.3
188	K	32.4	Very low	36.9	Very low	189 Å²	189	146.7 Å²	146.7	82%	0.822	79%	0.793	S	S	*	*				58.1	115.9	97.5	-167.2	171.6	-179.4	176.6	0	115.6
189	T	33.8	Very low	36.7	Very low	134 Å²	134	142.3 Å²	142.3	82%	0.822	79%	0.789	S	S	*	*			trans	178.8	98.2	138.6	-63	0	0	0	0	107.5
190	R	32.1	Very low	37	Very low	246 Å²	246	138.4 Å²	138.4	93%	0.928	79%	0.788	S	S	*	*				74.4	114.6	88.8	-163.8	-179	-147.4	-113.5	2.2	114.5
191	G	28.1	Very low	36.2	Very low	76 Å²	76	138.1 Å²	138.1	78%	0.784	79%	0.794	S	S	*	*			trans	123.7	92.6	146.4	0	0	0	0	0	117.6
192	S	31.3	Very low	35.9	Very low	120 Å²	120	140.4 Å²	140.4	84%	0.839	80%	0.8	S	S	*	*			trans	-81.6	175.4	145.5	-123.6	0	0	0	0	108.6
193	P	45.3	Very low	35.8	Very low	114 Å²	114	138.8 Å²	138.8	74%	0.74	80%	0.799	S	S	*	*			cis	-138.8	175.3	9.1	32.7	-9.5	0	0	0	116.1
194	E	36.8	Very low	37	Very low	159 Å²	159	133.4 Å²	133.4	74%	0.743	80%	0.795	S	S	*	*			trans	-62.2	158.8	161.9	-153.6	-171.6	105.1	0	0	112.1
195	P	40.9	Very low	37	Very low	121 Å²	121	134.8 Å²	134.8	79%	0.786	80%	0.803	S	S	*	*				-150.3	146.9	106.7	36.6	-18.3	0	0	0	116.6
196	S	33.1	Very low	36.9	Very low	93 Å²	93	134.4 Å²	134.4	65%	0.65	80%	0.801	S	S	*	*			trans	-69.5	167.3	151.8	-71.9	0	0	0	0	110.9
197	P	50.3	Low	36.8	Very low	108 Å²	108	132.1 Å²	132.1	70%	0.701	80%	0.798	S	S	*	*				-158.9	-174.6	50.3	40.1	-14.7	0	0	0	119.1
198	E	31.5	Very low	37.2	Very low	186 Å²	186	128.2 Å²	128.2	87%	0.869	79%	0.793	S	S	*	*			trans	67.4	149.2	149.5	-92.5	-180	99.6	0	0	120.5
199	A	32.8	Very low	37.9	Very low	94 Å²	94	125 Å²	125	78%	0.777	79%	0.791	S	S	*	*			cis	-161.1	175.4	18.2	0	0	0	0	0	112.1
200	A	40.3	Very low	38	Very low	99 Å²	99	125.8 Å²	125.8	82%	0.818	79%	0.785	S	S	*	*			trans	-79.2	167.2	-165.6	0	0	0	0	0	119
201	A	40	Very low	38.2	Very low	95 Å²	95	123 Å²	123	79%	0.785	78%	0.775	S	S	*	*			trans	177	134.4	131.8	0	0	0	0	0	114.8
202	D	36.3	Very low	38.8	Very low	168 Å²	168	129.1 Å²	129.1	90%	0.898	77%	0.774	S	S	*	*			trans	28.3	138.4	148.3	-88.6	-96.5	0	0	0	125.4
203	G	31.8	Very low	39.1	Very low	66 Å²	66	128.2 Å²	128.2	68%	0.68	77%	0.774	S	S	*	*			trans	-93.8	-151.2	168.7	0	0	0	0	0	113.4
204	P	56.5	Low	39	Very low	124 Å²	124	129.9 Å²	129.9	81%	0.805	77%	0.772	S	S	*	*			cis	-126.9	160.8	-20.6	38.9	-23.9	0	0	0	112.9
205	T	32.9	Very low	39.1	Very low	147 Å²	147	127.8 Å²	127.8	90%	0.902	77%	0.766	S	S	*	*			trans	-161.7	140.9	157.4	-77.9	0	0	0	0	111.9
206	V	35	Very low	39.6	Very low	129 Å²	129	128.2 Å²	128.2	78%	0.782	77%	0.769	S	S	*	*			trans	-76.6	134.9	-171.7	167.8	0	0	0	0	113.7
207	S	34.2	Very low	40.2	Very low	106 Å²	106	130.3 Å²	130.3	74%	0.741	77%	0.773	S	S	*	*			trans	13.8	160	147.4	-54.2	0	0	0	0	122.2
208	P	46	Very low	39.8	Very low	119 Å²	119	131.8 Å²	131.8	77%	0.773	78%	0.775	S	S	*	*			cis	-140.5	-179.8	26.4	37.4	-13.9	0	0	0	116.5
209	P	47.7	Very low	40.3	Very low	121 Å²	121	131.7 Å²	131.7	79%	0.786	77%	0.774	S	S	*	*			trans	-95.7	143.2	-163.9	36	-28.3	0	0	0	112.2
210	E	35.3	Very low	41	Very low	150 Å²	150	134.3 Å²	134.3	70%	0.701	77%	0.774	S	S	*	*			trans	-152.6	124.1	165.5	-112.3	-161.4	106.9	0	0	111.7
211	R	36.1	Very low	41.2	Very low	189 Å²	189	135.4 Å²	135.4	71%	0.713	77%	0.773	S	S	*	*			trans	95.2	101.9	146.8	-55.5	179	-66.4	-113.8	10.9	117.8
212	R	40.6	Very low	41.1	Very low	203 Å²	203	134 Å²	134	77%	0.766	77%	0.767	S	S	*	*			trans	70.7	100.8	135.2	-61.1	-163.4	-170.6	-109.7	2.7	118.1	E214	R212-E214 IonicContact CZ-OE2 2.79Å; R212-E214 IonicContact NH1-OE1 3.88Å; R212-E214 IonicContact NH1-OE2 3.08Å; R212-E214 PolarHBondContact NH1-OE2 2.86Å
213	A	38.5	Very low	41.5	Very low	102 Å²	102	131.2 Å²	131.2	84%	0.843	76%	0.761	S	S	*	*				-133.1	106.7	125.3	0	0	0	0	0	106.3	D215	A213-D215 PolarHBondContact O-N 3.27Å
214	E	43	Very low	42.3	Very low	148 Å²	148	134.1 Å²	134.1	69%	0.692	77%	0.767	S	S	*	*			trans	-67.5	112.9	175.6	-68.2	165.9	80.7	0	0	107.5	R212	R212-E214 IonicContact CZ-OE2 2.79Å; R212-E214 IonicContact NH1-OE1 3.88Å; R212-E214 IonicContact NH1-OE2 3.08Å; R212-E214 PolarHBondContact NH1-OE2 2.86Å
215	D	38.7	Very low	41.9	Very low	116 Å²	116	130 Å²	130	62%	0.62	75%	0.748	S	S	*	*			trans	-71.7	124.4	167.9	-173.1	-40.4	0	0	0	108	A213 N217	A213-D215 PolarHBondContact O-N 3.27Å; D215-N217 PolarHBondContact O-N 3.28Å; D215-N217 VanDerWaalsContact O-N 3.14Å; D215-N217 WeakPolarHBondContact OD1-CB 3.25Å; D215-N217 PolarHBondContact OD1-N 2.94Å
216	P	51.1	Low	42.8	Very low	129 Å²	129	129.3 Å²	129.3	84%	0.838	75%	0.746	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.6	12.4	-179.5	-1.2	16	0	0	0	114.9
217	N	46.1	Very low	43.3	Very low	137 Å²	137	133.7 Å²	133.7	73%	0.733	75%	0.748	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.2	5.5	-172.6	-156.9	46	0	0	0	116.4	D215	D215-N217 PolarHBondContact O-N 3.28Å; D215-N217 VanDerWaalsContact O-N 3.14Å; D215-N217 WeakPolarHBondContact OD1-CB 3.25Å; D215-N217 PolarHBondContact OD1-N 2.94Å
218	D	41.9	Very low	44.3	Very low	140 Å²	140	134.7 Å²	134.7	75%	0.749	75%	0.745	S	S	*	*			trans	-102.9	68.7	172.5	-80.1	-46.2	0	0	0	112.3
219	Q	41.5	Very low	44.7	Very low	183 Å²	183	135.3 Å²	135.3	86%	0.855	75%	0.746	S	S	*	*			trans	-115.8	83.7	153.3	-81.8	-176.5	82.9	0	0	108.4	P221	Q219-P221 VanDerWaalsContact O-CD 3.23Å; Q219-P221 WeakPolarHBondContact O-CD 3.31Å
220	I	46.9	Very low	44.7	Very low	149 Å²	149	132.2 Å²	132.2	76%	0.764	73%	0.726	S	S	*	*			trans	-66.4	112.9	156	-59.1	177.5	0	0	0	106.3
221	P	44.3	Very low	45.9	Very low	123 Å²	123	128.5 Å²	128.5	80%	0.799	72%	0.716	S	S	*	*			trans	-85	121.8	170.9	31.1	-21.5	0	0	0	108.5	Q219	Q219-P221 VanDerWaalsContact O-CD 3.23Å; Q219-P221 WeakPolarHBondContact O-CD 3.31Å
222	G	38.8	Very low	47	Very low	64 Å²	64	127.2 Å²	127.2	66%	0.66	72%	0.719	S	S	*	*			trans	99.3	95.1	150.8	0	0	0	0	0	114.7
223	S	44.4	Very low	47.6	Very low	111 Å²	111	124.4 Å²	124.4	78%	0.776	71%	0.714	S	S	*	*			trans	-37.1	135.7	141	-52.1	0	0	0	0	109.8	G225	S223-G225 PolarHBondContact O-N 2.73Å
224	P	48.8	Very low	48.6	Very low	126 Å²	126	127.1 Å²	127.1	82%	0.818	70%	0.703	S	S	*	*			trans	-58	106.9	168.8	-15.3	27.5	0	0	0	106.8
225	G	47.7	Very low	49.3	Very low	38 Å²	38	124.1 Å²	124.1	39%	0.392	69%	0.691	S	S	.	*			trans	-55.8	160.6	179.7	0	0	0	0	0	110.7	S223 W227	S223-G225 PolarHBondContact O-N 2.73Å; G225-W227 PolarHBondContact O-N 2.83Å
226	P	51.8	Low	50.1	Low	133 Å²	133	119.9 Å²	119.9	86%	0.864	67%	0.671	S	S	*	*			trans	-70.6	85.4	-179.7	31.6	-32.3	0	0	0	108	L228	P226-L228 PolarHBondContact O-N 3.12Å
227	W	46.3	Very low	50.4	Low	220 Å²	220	123.8 Å²	123.8	83%	0.833	67%	0.669	S	S	*	*			trans	-65.6	89	168.7	-68.6	99.9	0	0	0	107.4	G225 V229	G225-W227 PolarHBondContact O-N 2.83Å; W227-V229 PolarHBondContact O-N 2.79Å; W227-V229 VanDerWaalsContact O-N 3.12Å
228	L	54.5	Low	50.9	Low	128 Å²	128	121.4 Å²	121.4	67%	0.67	67%	0.668	S	S	*	*			trans	35.3	69.1	157.3	-79.2	142.1	0	0	0	113.3	P226 P230	P226-L228 PolarHBondContact O-N 3.12Å; L228-P230 WeakPolarHBondContact O-CD 3.09Å; L228-P230 VanDerWaalsContact O-N 3.12Å
229	V	54.5	Low	51.6	Low	131 Å²	131	121 Å²	121	79%	0.794	67%	0.665	S	S	*	*			trans	-62.6	110.6	152.4	-179.3	0	0	0	0	104.7	W227 S231	W227-V229 PolarHBondContact O-N 2.79Å; W227-V229 VanDerWaalsContact O-N 3.12Å; V229-S231 PolarHBondContact O-N 2.96Å
230	P	48	Very low	52.3	Low	57 Å²	57	115.5 Å²	115.5	37%	0.37	66%	0.657	S	S	.	*			trans	-63.6	118.1	176	-11.1	27.6	0	0	0	105.1	L228 E232 R234 L235	L228-P230 WeakPolarHBondContact O-CD 3.09Å; L228-P230 VanDerWaalsContact O-N 3.12Å; P230-E232 PolarHBondContact O-N 3.49Å; P230-R234 HydrophobicContact CB-CB 4.42Å; P230-L235 HydrophobicContact CB-CD2 4.11Å; P230-L235 HydrophobicContact CB-CG 4.1Å; P230-L235 HydrophobicContact CG-CD2 4.26Å
231	S	61.2	Low	52.9	Low	71 Å²	71	112.8 Å²	112.8	50%	0.497	65%	0.647	S	S	.	*			trans	-49.1	140.7	175	26.3	0	0	0	0	108.7	V229 E233 R234 L235	V229-S231 PolarHBondContact O-N 2.96Å; S231-E233 PolarHBondContact O-N 3.31Å; S231-R234 WeakPolarHBondContact O-CA 3.44Å; S231-R234 WeakPolarHBondContact O-CB 3.39Å; S231-R234 PolarHBondContact O-N 3.1Å; S231-L235 PolarHBondContact O-N 2.96Å
232	E	58.6	Low	53.2	Low	163 Å²	163	115 Å²	115	76%	0.762	64%	0.64	S	S	*	*	H	α-helix	trans	-49.1	-34.9	-174.3	-169.9	172.7	118.5	0	0	112	P230 R234 L235 S236	P230-E232 PolarHBondContact O-N 3.49Å; E232-R234 VanDerWaalsContact C-N 3.34Å; E232-R234 PolarHBondContact O-N 3.35Å; E232-L235 WeakPolarHBondContact O-CB 3.34Å; E232-L235 PolarHBondContact O-N 3.03Å; E232-L235 VanDerWaalsContact O-N 3.1Å; E232-S236 PolarHBondContact O-N 3.39Å; E232-S236 PolarHBondContact O-OG 3.11Å; E232-S236 VanDerWaalsContact O-OG 3.07Å
233	E	52.8	Low	53.9	Low	144 Å²	144	113.1 Å²	113.1	67%	0.673	62%	0.62	S	S	*	*	H	α-helix	trans	-59.8	-35	174.4	-164.6	172.7	90	0	0	114.5	S231 R237	S231-E233 PolarHBondContact O-N 3.31Å; E233-R237 PolarHBondContact O-N 3.06Å; E233-R237 VanDerWaalsContact O-N 3.11Å
234	R	60.9	Low	54.4	Low	159 Å²	159	111.9 Å²	111.9	60%	0.6	62%	0.617	S	S	*	*	H	α-helix	trans	-73.7	-35.4	173.5	-70.9	-173.3	70.4	179.5	1.2	111.9	P230 S231 E232 A238	P230-R234 HydrophobicContact CB-CB 4.42Å; S231-R234 WeakPolarHBondContact O-CA 3.44Å; S231-R234 WeakPolarHBondContact O-CB 3.39Å; S231-R234 PolarHBondContact O-N 3.1Å; E232-R234 VanDerWaalsContact C-N 3.34Å; E232-R234 PolarHBondContact O-N 3.35Å; R234-A238 WeakPolarHBondContact O-CB 3.3Å; R234-A238 PolarHBondContact O-N 2.74Å
235	L	57.7	Low	54.7	Low	84 Å²	84	109.4 Å²	109.4	44%	0.44	61%	0.608	S	S	.	*	H	α-helix	trans	-67.3	-42.9	174.4	-67.7	173.8	0	0	0	110.7	P230 S231 E232 R237 A238 L239	P230-L235 HydrophobicContact CB-CD2 4.11Å; P230-L235 HydrophobicContact CB-CG 4.1Å; P230-L235 HydrophobicContact CG-CD2 4.26Å; S231-L235 PolarHBondContact O-N 2.96Å; E232-L235 WeakPolarHBondContact O-CB 3.34Å; E232-L235 PolarHBondContact O-N 3.03Å; E232-L235 VanDerWaalsContact O-N 3.1Å; L235-R237 PolarHBondContact O-N 3.35Å; L235-A238 PolarHBondContact O-N 3.13Å; L235-L239 WeakPolarHBondContact O-CB 3.49Å; L235-L239 VanDerWaalsContact O-CG 3.3Å; L235-L239 WeakPolarHBondContact O-CG 3.47Å; L235-L239 PolarHBondContact O-N 3.13Å
236	S	55.5	Low	55	Low	28 Å²	28	112.9 Å²	112.9	20%	0.196	61%	0.614	C	S	.	*	H	α-helix	trans	-63.3	-42	176.9	-54.2	0	0	0	0	112.4	E232 L239 G240 V241	E232-S236 PolarHBondContact O-N 3.39Å; E232-S236 PolarHBondContact O-OG 3.11Å; E232-S236 VanDerWaalsContact O-OG 3.07Å; S236-L239 PolarHBondContact O-N 3.47Å; S236-G240 PolarHBondContact O-N 3.18Å; S236-V241 CarbonylContact C-O 3.59Å; S236-V241 WeakPolarHBondContact CB-O 3.36Å; S236-V241 PolarHBondContact O-N 3.07Å; S236-V241 VanDerWaalsContact O-N 3.13Å; S236-V241 VanDerWaalsContact O-O 3.13Å
237	R	56.9	Low	55.1	Low	211 Å²	211	111.8 Å²	111.8	80%	0.796	60%	0.6	S	S	*	*	H	α-helix	trans	-65.1	-39.3	175.1	-83.2	-175.1	172.2	-163.7	0.4	113.2	E233 L235 G240	E233-R237 PolarHBondContact O-N 3.06Å; E233-R237 VanDerWaalsContact O-N 3.11Å; L235-R237 PolarHBondContact O-N 3.35Å; R237-G240 PolarHBondContact O-N 3.49Å
238	A	55.8	Low	55.6	Low	87 Å²	87	104.2 Å²	104.2	72%	0.719	58%	0.584	S	S	*	*	H	α-helix	trans	-72.6	-32.5	179.8	0	0	0	0	0	112.8	R234 L235 G240	R234-A238 WeakPolarHBondContact O-CB 3.3Å; R234-A238 PolarHBondContact O-N 2.74Å; L235-A238 PolarHBondContact O-N 3.13Å; A238-G240 VanDerWaalsContact C-N 3.31Å
239	L	57.1	Low	55.6	Low	132 Å²	132	105 Å²	105	69%	0.691	59%	0.585	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.9	-2.2	177.5	-66.8	169.7	0	0	0	113.3	L235 S236 V241	L235-L239 WeakPolarHBondContact O-CB 3.49Å; L235-L239 VanDerWaalsContact O-CG 3.3Å; L235-L239 WeakPolarHBondContact O-CG 3.47Å; L235-L239 PolarHBondContact O-N 3.13Å; S236-L239 PolarHBondContact O-N 3.47Å; L239-V241 HydrophobicContact CB-CG2 4.04Å; L239-V241 PolarHBondContact O-N 2.89Å; L239-V241 VanDerWaalsContact O-N 3.13Å
240	G	55.8	Low	55.6	Low	67 Å²	67	103.6 Å²	103.6	69%	0.691	57%	0.569	S	S	*	*	T	Hydrogen-bonded Turn	trans	65.1	11.4	-177.3	0	0	0	0	0	114	S236 R237 A238 R242	S236-G240 PolarHBondContact O-N 3.18Å; R237-G240 PolarHBondContact O-N 3.49Å; A238-G240 VanDerWaalsContact C-N 3.31Å; G240-R242 PolarHBondContact O-N 2.99Å
241	V	59.3	Low	56.1	Low	92 Å²	92	107.8 Å²	107.8	56%	0.558	59%	0.585	S	S	*	*			trans	-86	110.7	177.7	-176.3	0	0	0	0	106.8	S236 L239 G243	S236-V241 CarbonylContact C-O 3.59Å; S236-V241 WeakPolarHBondContact CB-O 3.36Å; S236-V241 PolarHBondContact O-N 3.07Å; S236-V241 VanDerWaalsContact O-N 3.13Å; S236-V241 VanDerWaalsContact O-O 3.13Å; L239-V241 HydrophobicContact CB-CG2 4.04Å; L239-V241 PolarHBondContact O-N 2.89Å; L239-V241 VanDerWaalsContact O-N 3.13Å; V241-G243 PolarHBondContact O-N 3.44Å
242	R	51.7	Low	55.9	Low	168 Å²	168	108.3 Å²	108.3	63%	0.634	59%	0.594	S	S	*	*			trans	-52.7	113.5	169.6	-94.5	-176.9	173.3	-171.8	-1.3	108	G240 E250	G240-R242 PolarHBondContact O-N 2.99Å; R242-E250 IonicContact NH1-OE1 2.97Å; R242-E250 IonicContact NH1-OE2 3.66Å; R242-E250 PolarHBondContact NH1-OE2 3.47Å; R242-E250 VanDerWaalsContact NH1-OE2 3.08Å
243	G	52.2	Low	55.9	Low	25 Å²	25	104.5 Å²	104.5	26%	0.258	59%	0.59	S	S	.	*			trans	-59.6	144.5	-178.6	0	0	0	0	0	111.4	V241 A245 Q246	V241-G243 PolarHBondContact O-N 3.44Å; G243-A245 PolarHBondContact O-N 3.08Å; G243-Q246 PolarHBondContact O-N 3.44Å
244	A	55.6	Low	56	Low	85 Å²	85	100.4 Å²	100.4	70%	0.702	59%	0.587	S	S	*	*	H	α-helix	trans	-54.6	-26.5	-176.2	0	0	0	0	0	113.8	Q246 L247 A248	A244-Q246 VanDerWaalsContact C-N 3.33Å; A244-Q246 PolarHBondContact O-N 2.9Å; A244-L247 PolarHBondContact O-N 3.03Å; A244-A248 PolarHBondContact O-N 3.42Å
245	A	54.6	Low	56	Low	75 Å²	75	104 Å²	104	62%	0.62	60%	0.601	S	S	*	*	H	α-helix	trans	-63.9	-33.7	174.7	0	0	0	0	0	113.4	G243 A248 Q249	G243-A245 PolarHBondContact O-N 3.08Å; A245-A248 PolarHBondContact O-N 2.94Å; A245-Q249 PolarHBondContact O-N 3.47Å
246	Q	54.4	Low	55.9	Low	111 Å²	111	111.3 Å²	111.3	52%	0.519	62%	0.622	S	S	.	*	H	α-helix	trans	-79.6	-32	179.6	-164.4	155.1	-12.1	0	0	111.8	G243 A244 A248 Q249 E250	G243-Q246 PolarHBondContact O-N 3.44Å; A244-Q246 VanDerWaalsContact C-N 3.33Å; A244-Q246 PolarHBondContact O-N 2.9Å; Q246-A248 VanDerWaalsContact C-N 3.35Å; Q246-Q249 PolarHBondContact O-N 3.03Å; Q246-E250 VanDerWaalsContact O-CB 3.27Å; Q246-E250 WeakPolarHBondContact O-CB 3.27Å; Q246-E250 PolarHBondContact O-N 3.49Å
247	L	53.4	Low	55.9	Low	110 Å²	110	121.1 Å²	121.1	58%	0.576	66%	0.655	S	S	*	*	H	α-helix	trans	-65.3	-38.9	169.3	-172.2	73.6	0	0	0	111.2	A244 E250 M251	A244-L247 PolarHBondContact O-N 3.03Å; L247-E250 PolarHBondContact O-N 2.92Å; L247-M251 VanDerWaalsContact O-CB 3.29Å; L247-M251 WeakPolarHBondContact O-CB 3.32Å; L247-M251 WeakPolarHBondContact O-CG 3.27Å; L247-M251 PolarHBondContact O-N 2.93Å
248	A	56.7	Low	55.5	Low	61 Å²	61	123.7 Å²	123.7	50%	0.504	68%	0.676	S	S	.	*	H	α-helix	trans	-67.9	-40.2	175.6	0	0	0	0	0	112.5	A244 A245 Q246 A252	A244-A248 PolarHBondContact O-N 3.42Å; A245-A248 PolarHBondContact O-N 2.94Å; Q246-A248 VanDerWaalsContact C-N 3.35Å; A248-A252 VanDerWaalsContact O-CB 3.27Å; A248-A252 WeakPolarHBondContact O-CB 3.29Å; A248-A252 PolarHBondContact O-N 3.02Å
249	Q	55.7	Low	55.5	Low	145 Å²	145	125.6 Å²	125.6	68%	0.678	67%	0.674	S	S	*	*	H	α-helix	trans	-66.7	-38	173.4	-86.2	176.6	-14.5	0	0	112.8	A245 Q246 A252 A253	A245-Q249 PolarHBondContact O-N 3.47Å; Q246-Q249 PolarHBondContact O-N 3.03Å; Q249-A252 PolarHBondContact O-N 2.97Å; Q249-A253 WeakPolarHBondContact O-CB 3.08Å; Q249-A253 PolarHBondContact O-N 3.45Å
250	E	53.7	Low	55.4	Low	101 Å²	101	125.2 Å²	125.2	47%	0.472	67%	0.673	S	S	.	*	H	α-helix	trans	-69.7	-38.6	177.2	-164.5	169.2	-169.3	0	0	111.5	R242 Q246 L247 A253 G254	R242-E250 IonicContact NH1-OE1 2.97Å; R242-E250 IonicContact NH1-OE2 3.66Å; R242-E250 PolarHBondContact NH1-OE2 3.47Å; R242-E250 VanDerWaalsContact NH1-OE2 3.08Å; Q246-E250 VanDerWaalsContact O-CB 3.27Å; Q246-E250 WeakPolarHBondContact O-CB 3.27Å; Q246-E250 PolarHBondContact O-N 3.49Å; L247-E250 PolarHBondContact O-N 2.92Å; E250-A253 PolarHBondContact O-N 3.44Å; E250-G254 PolarHBondContact O-N 3.12Å; E250-G254 VanDerWaalsContact O-N 3.12Å
251	M	57.8	Low	55.3	Low	144 Å²	144	128.4 Å²	128.4	71%	0.709	67%	0.672	S	S	*	*	H	α-helix	trans	-68.9	-35.4	173.1	-70.6	-101.7	-74	0	0	112.9	L247	L247-M251 VanDerWaalsContact O-CB 3.29Å; L247-M251 WeakPolarHBondContact O-CB 3.32Å; L247-M251 WeakPolarHBondContact O-CG 3.27Å; L247-M251 PolarHBondContact O-N 2.93Å
252	A	57.2	Low	55.1	Low	82 Å²	82	130.6 Å²	130.6	68%	0.678	68%	0.679	S	S	*	*	H	α-helix	trans	-72.9	-33.8	176	0	0	0	0	0	112.5	A248 Q249 G254	A248-A252 VanDerWaalsContact O-CB 3.27Å; A248-A252 WeakPolarHBondContact O-CB 3.29Å; A248-A252 PolarHBondContact O-N 3.02Å; Q249-A252 PolarHBondContact O-N 2.97Å; A252-G254 VanDerWaalsContact C-N 3.34Å
253	A	58.8	Low	55.3	Low	83 Å²	83	128.3 Å²	128.3	69%	0.686	68%	0.681	S	S	*	*	H	α-helix	trans	-78.4	-16.3	176.2	0	0	0	0	0	113.6	Q249 E250 R255	Q249-A253 WeakPolarHBondContact O-CB 3.08Å; Q249-A253 PolarHBondContact O-N 3.45Å; E250-A253 PolarHBondContact O-N 3.44Å; A253-R255 PolarHBondContact O-N 3.49Å
254	G	55.9	Low	55.5	Low	59 Å²	59	135.1 Å²	135.1	61%	0.608	71%	0.71	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.4	1.2	-175.9	0	0	0	0	0	116.8	E250 A252	E250-G254 PolarHBondContact O-N 3.12Å; E250-G254 VanDerWaalsContact O-N 3.12Å; A252-G254 VanDerWaalsContact C-N 3.34Å
255	R	59.5	Low	55.5	Low	235 Å²	235	138.7 Å²	138.7	89%	0.887	71%	0.71	S	S	*	*	S	Bend	trans	-104.4	52	177.1	-86	-166	176.6	-124.5	3.4	113.4	A253	A253-R255 PolarHBondContact O-N 3.49Å
256	R	56.9	Low	55.6	Low	236 Å²	236	143.6 Å²	143.6	89%	0.891	72%	0.717	S	S	*	*	S	Bend	trans	-154.1	60.7	157.8	-81.7	-151.2	-173.3	-110.1	2.8	112.1
257	R	54.3	Low	55.7	Low	234 Å²	234	146.3 Å²	146.3	88%	0.883	73%	0.734	S	S	*	*			trans	-155.9	91.4	145.6	-67.9	-160	-170.6	-96.5	-2.9	108.1
258	H	48.8	Very low	55.9	Low	266 Å²	266	149.6 Å²	149.6	100%	1.231	75%	0.748	S	S	*	*			trans	173.1	0	133.5	-93	-67.9	0	0	0	107.8

Retrieved 258 of 258 residues in 251.4 ms (Link to these results)

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