A0A077Z9A5_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077Z9A5, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 467 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

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	27.2	Very low	24.2	Very low	243 Å²	243	157.4 Å²	157.4	100%	1.197	83%	0.825	S	S	*	*				0	117.6	0	-87.5	175.4	137.4	0	0	107.8
2	V	19.3	Very low	24.5	Very low	134 Å²	134	159.6 Å²	159.6	81%	0.812	84%	0.837	S	S	*	*			trans	-96.6	119.4	173.8	-176.3	0	0	0	0	107.8
3	P	23.4	Very low	24.7	Very low	125 Å²	125	167 Å²	167	81%	0.812	85%	0.846	S	S	*	*			trans	-80.1	123.9	177.4	29.8	-29	0	0	0	109.9
4	Y	21.4	Very low	24.8	Very low	203 Å²	203	159.1 Å²	159.1	80%	0.796	83%	0.827	S	S	*	*			trans	-108.3	131	163.4	56.4	-91.3	0	0	0	109.8	V6	Y4-V6 HydrophobicContact CD2-CG2 4.34Å
5	Q	22.2	Very low	25	Very low	160 Å²	160	164.8 Å²	164.8	75%	0.748	83%	0.834	S	S	*	*			trans	-102.9	102.9	-176.1	-169.6	-179.1	18.4	0	0	108.6	H7	Q5-H7 PolarHBondContact O-N 3.1Å; Q5-H7 VanDerWaalsContact O-N 3.15Å
6	V	24.7	Very low	25.2	Very low	128 Å²	128	167.2 Å²	167.2	78%	0.776	84%	0.837	S	S	*	*			trans	-74	106.9	169.7	-173.3	0	0	0	0	107.6	Y4 S8	Y4-V6 HydrophobicContact CD2-CG2 4.34Å; V6-S8 PolarHBondContact O-N 3.31Å
7	H	23.4	Very low	25.4	Very low	150 Å²	150	167.5 Å²	167.5	69%	0.694	84%	0.836	S	S	*	*			trans	-64.9	111.7	171.5	-88.6	57.6	0	0	0	108.6	Q5 D9	Q5-H7 PolarHBondContact O-N 3.1Å; Q5-H7 VanDerWaalsContact O-N 3.15Å; H7-D9 PolarHBondContact O-N 2.95Å
8	S	25.7	Very low	25.3	Very low	109 Å²	109	171.3 Å²	171.3	76%	0.762	84%	0.839	S	S	*	*			trans	-68.7	119.1	167.2	69	0	0	0	0	108.2	V6 R10	V6-S8 PolarHBondContact O-N 3.31Å; S8-R10 PolarHBondContact O-N 3.49Å
9	D	26.5	Very low	25.4	Very low	160 Å²	160	173.8 Å²	173.8	86%	0.856	84%	0.838	S	S	*	*			trans	-52.6	130.5	178.6	-104.1	-35.4	0	0	0	111.7	H7 G11	H7-D9 PolarHBondContact O-N 2.95Å; D9-G11 PolarHBondContact O-N 3.1Å
10	R	25.1	Very low	25.3	Very low	255 Å²	255	171.8 Å²	171.8	96%	0.962	83%	0.825	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.3	95.8	-179.2	-70.8	175.4	175.6	178.1	-0.7	109.3	S8	S8-R10 PolarHBondContact O-N 3.49Å
11	G	27	Very low	25.3	Very low	64 Å²	64	175 Å²	175	66%	0.66	83%	0.829	S	S	*	*	T	Hydrogen-bonded Turn	trans	-154.7	-21	172.1	0	0	0	0	0	115.9	D9 R13	D9-G11 PolarHBondContact O-N 3.1Å; G11-R13 VanDerWaalsContact C-N 3.33Å; G11-R13 PolarHBondContact O-N 2.68Å
12	L	28.4	Very low	25.1	Very low	184 Å²	184	171.1 Å²	171.1	96%	0.963	80%	0.802	S	S	*	*			trans	-87.4	68.8	-175.1	-66.8	166.1	0	0	0	111.9
13	R	27.1	Very low	25.2	Very low	256 Å²	256	173 Å²	173	97%	0.966	81%	0.806	S	S	*	*			trans	-84.6	101.3	158.4	-82.2	-169.8	-174.5	-136.9	3.4	108.2	G11	G11-R13 VanDerWaalsContact C-N 3.33Å; G11-R13 PolarHBondContact O-N 2.68Å
14	G	26.1	Very low	25.2	Very low	56 Å²	56	173.2 Å²	173.2	58%	0.577	81%	0.805	S	S	*	*	S	Bend	trans	147.3	93.1	166.8	0	0	0	0	0	114.3	F16	G14-F16 PolarHBondContact O-N 3.45Å
15	R	27.7	Very low	25.2	Very low	245 Å²	245	168.7 Å²	168.7	93%	0.925	80%	0.801	S	S	*	*	S	Bend	trans	55.5	49.9	152.6	-53.9	-174.9	-171.4	-172.7	2.9	118.4
16	F	28	Very low	25.2	Very low	203 Å²	203	170.9 Å²	170.9	89%	0.89	81%	0.808	S	S	*	*			trans	-137.2	132.3	158.7	-76.5	-79.6	0	0	0	111.5	G14	G14-F16 PolarHBondContact O-N 3.45Å
17	Q	28.3	Very low	25.1	Very low	173 Å²	173	170.4 Å²	170.4	81%	0.808	81%	0.805	S	S	*	*			trans	-50.9	135.9	-175.6	-74.6	168.1	-29.1	0	0	111.1	W19	Q17-W19 PolarHBondContact O-N 3.4Å; Q17-W19 VanDerWaalsContact O-N 3.14Å
18	R	24.5	Very low	25.1	Very low	236 Å²	236	168.5 Å²	168.5	89%	0.891	81%	0.806	S	S	*	*			trans	-66.9	105.3	175.1	-75.1	173.6	169	169.6	-5	109.8	K20	R18-K20 PolarHBondContact O-N 3.45Å
19	W	26.2	Very low	24.9	Very low	218 Å²	218	168.4 Å²	168.4	83%	0.826	81%	0.812	S	S	*	*			trans	-78.1	107.6	167.1	-73.2	48	0	0	0	108.5	Q17	Q17-W19 PolarHBondContact O-N 3.4Å; Q17-W19 VanDerWaalsContact O-N 3.14Å
20	K	24.2	Very low	24.7	Very low	133 Å²	133	167.9 Å²	167.9	58%	0.578	81%	0.808	S	S	*	*			trans	-88.5	116	166.2	-81.2	176.2	175.1	164.5	0	107.8	R18 Y22	R18-K20 PolarHBondContact O-N 3.45Å; K20-Y22 HydrophobicContact CB-CE2 4.03Å
21	R	24.7	Very low	24.7	Very low	240 Å²	240	159.8 Å²	159.8	91%	0.906	78%	0.784	S	S	*	*			trans	-83.3	130.4	168.2	-67.6	-177.8	173.8	-173.6	-3.6	108.7
22	Y	22.3	Very low	24.6	Very low	162 Å²	162	161.8 Å²	161.8	64%	0.635	79%	0.786	S	S	*	*			trans	-107.5	138.3	174.6	-65.6	-85.3	0	0	0	109.5	K20	K20-Y22 HydrophobicContact CB-CE2 4.03Å
23	L	22	Very low	24.5	Very low	172 Å²	172	159.5 Å²	159.5	90%	0.901	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-81	116.6	166.8	-86	152	0	0	0	108.1
24	V	23.4	Very low	24.3	Very low	130 Å²	130	154.1 Å²	154.1	79%	0.788	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-79.8	135.6	174.7	-178.9	0	0	0	0	109.1
25	P	21.1	Very low	24.2	Very low	109 Å²	109	157.7 Å²	157.7	71%	0.708	76%	0.761	S	S	*	*	P	Polyproline II helix	trans	-65.2	142.9	-176.2	-15.3	28.6	0	0	0	112.7	V27	P25-V27 PolarHBondContact O-N 3.3Å; P25-V27 VanDerWaalsContact O-N 3.13Å
26	K	22.9	Very low	24	Very low	205 Å²	205	152.8 Å²	152.8	89%	0.891	76%	0.759	S	S	*	*			trans	-57	111.5	162.7	-97.9	179.4	170.5	179.4	0	108.8
27	V	22.8	Very low	23.9	Very low	119 Å²	119	149 Å²	149	72%	0.721	75%	0.747	S	S	*	*			trans	-63.9	137.1	166.5	-179.6	0	0	0	0	108.2	P25	P25-V27 PolarHBondContact O-N 3.3Å; P25-V27 VanDerWaalsContact O-N 3.13Å
28	P	22.5	Very low	23.7	Very low	109 Å²	109	146.3 Å²	146.3	71%	0.708	74%	0.738	S	S	*	*			trans	-60.3	147	-178.6	-15.7	28.6	0	0	0	110.8	L30	P28-L30 PolarHBondContact O-N 2.88Å
29	A	21.5	Very low	23.7	Very low	108 Å²	108	142.8 Å²	142.8	89%	0.893	73%	0.725	S	S	*	*			trans	-52.4	101.5	177	0	0	0	0	0	111.1
30	L	23.1	Very low	23.6	Very low	148 Å²	148	136.3 Å²	136.3	78%	0.775	72%	0.718	S	S	*	*			trans	-72.2	139	164.7	-78	160.9	0	0	0	108.1	P28	P28-L30 PolarHBondContact O-N 2.88Å
31	N	25.1	Very low	23.5	Very low	86 Å²	86	136.9 Å²	136.9	46%	0.46	73%	0.726	S	S	.	*			trans	-48.6	119.8	-169.9	-165.2	-1.9	0	0	0	111.4	D33 Q34	N31-D33 PolarHBondContact O-N 3.33Å; N31-Q34 PolarHBondContact O-N 2.98Å; N31-Q34 VanDerWaalsContact O-N 3.1Å
32	P	25.1	Very low	23.5	Very low	106 Å²	106	133.8 Å²	133.8	69%	0.688	72%	0.724	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.8	-7.9	-177.1	24.7	-34.1	0	0	0	114.2
33	D	25.3	Very low	23.6	Very low	135 Å²	135	134.4 Å²	134.4	72%	0.722	73%	0.733	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.1	4.9	179.4	-60.6	-35.9	0	0	0	113.8	N31	N31-D33 PolarHBondContact O-N 3.33Å
34	Q	23.2	Very low	23.8	Very low	144 Å²	144	129.6 Å²	129.6	67%	0.673	73%	0.725	S	S	*	*			trans	-106.8	94.2	174.8	-80.3	178.3	-34.7	0	0	110.9	N31	N31-Q34 PolarHBondContact O-N 2.98Å; N31-Q34 VanDerWaalsContact O-N 3.1Å
35	H	25.3	Very low	23.8	Very low	130 Å²	130	133.5 Å²	133.5	60%	0.602	73%	0.731	S	S	*	*			trans	-84.9	115.4	-179.4	-84.5	-87.6	0	0	0	112.2	L37	H35-L37 PolarHBondContact O-N 3.35Å
36	V	22.9	Very low	24	Very low	143 Å²	143	132.6 Å²	132.6	87%	0.867	73%	0.733	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.1	19.8	173.2	178.8	0	0	0	0	112.2
37	L	25.1	Very low	24	Very low	123 Å²	123	127.7 Å²	127.7	64%	0.644	72%	0.722	S	S	*	*	T	Hydrogen-bonded Turn	trans	-133.5	8.2	-172.5	-97	150.3	0	0	0	115.1	H35 W39	H35-L37 PolarHBondContact O-N 3.35Å; L37-W39 VanDerWaalsContact C-N 3.32Å; L37-W39 PolarHBondContact O-N 3.06Å
38	D	24.8	Very low	24.1	Very low	117 Å²	117	128.1 Å²	128.1	63%	0.626	73%	0.725	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.4	4.9	-178.7	-81.1	-23.4	0	0	0	115.5
39	W	24.3	Very low	24.3	Very low	161 Å²	161	130.1 Å²	130.1	61%	0.61	73%	0.73	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110	-6.4	179.9	-86.3	52.8	0	0	0	115.1	L37 L137	L37-W39 VanDerWaalsContact C-N 3.32Å; L37-W39 PolarHBondContact O-N 3.06Å; W39-L137 HydrophobicContact CB-CB 4.14Å; W39-L137 HydrophobicContact CB-CD1 3.63Å; W39-L137 HydrophobicContact CB-CD2 3.27Å; W39-L137 HydrophobicContact CB-CG 3.78Å; W39-L137 HydrophobicContact CD2-CB 3.48Å; W39-L137 VanDerWaalsContact CD2-CB 3.48Å; W39-L137 HydrophobicContact CD2-CD1 3.15Å; W39-L137 HydrophobicContact CD2-CD2 4.23Å; W39-L137 HydrophobicContact CD2-CG 3.69Å; W39-L137 HydrophobicContact CE3-CB 2.95Å; W39-L137 HydrophobicContact CE3-CD1 3.69Å; W39-L137 HydrophobicContact CE3-CD2 4.36Å; W39-L137 HydrophobicContact CE3-CG 3.74Å; W39-L137 HydrophobicContact CG-CB 4.07Å; W39-L137 HydrophobicContact CG-CD1 3.22Å; W39-L137 HydrophobicContact CG-CD2 3.91Å; W39-L137 HydrophobicContact CG-CG 3.83Å; W39-L137 HydrophobicContact CH2-CB 3.99Å; W39-L137 HydrophobicContact CH2-CD1 4.27Å; W39-L137 HydrophobicContact CZ2-CB 4.47Å; W39-L137 HydrophobicContact CZ2-CD1 3.91Å; W39-L137 HydrophobicContact CZ3-CB 3.25Å; W39-L137 HydrophobicContact CZ3-CD1 4.21Å; W39-L137 HydrophobicContact CZ3-CG 4.28Å
40	A	24.1	Very low	24.4	Very low	82 Å²	82	130.2 Å²	130.2	68%	0.678	71%	0.714	S	S	*	*	S	Bend	trans	-95.1	0.7	179.2	0	0	0	0	0	114
41	L	22.8	Very low	24.4	Very low	145 Å²	145	127.8 Å²	127.8	76%	0.759	71%	0.706	S	S	*	*			trans	-129.5	12.5	-168.7	-74.7	167.6	0	0	0	114.9	E43	L41-E43 PolarHBondContact O-N 3.48Å
42	M	24.1	Very low	24.3	Very low	175 Å²	175	130.3 Å²	130.3	86%	0.862	73%	0.727	S	S	*	*			trans	-70.9	118.5	173.6	-81.9	-84.4	-94.4	0	0	111.3
43	E	24.6	Very low	24.2	Very low	176 Å²	176	129.9 Å²	129.9	82%	0.822	73%	0.727	S	S	*	*			trans	-58.8	126.6	-169.6	-61.1	177.8	136.2	0	0	114.8	L41	L41-E43 PolarHBondContact O-N 3.48Å
44	G	24.8	Very low	24.1	Very low	71 Å²	71	129.8 Å²	129.8	73%	0.732	72%	0.722	S	S	*	*			trans	-150.7	121.7	163.9	0	0	0	0	0	109.9	A46	G44-A46 PolarHBondContact O-N 2.98Å
45	K	25.1	Very low	24.1	Very low	211 Å²	211	131.6 Å²	131.6	92%	0.917	72%	0.724	S	S	*	*	P	Polyproline II helix	trans	-46.2	122.7	-172.7	-65.7	170.6	178.6	174.3	0	113
46	A	23.6	Very low	23.9	Very low	90 Å²	90	132.6 Å²	132.6	74%	0.744	73%	0.734	S	S	*	*	P	Polyproline II helix	trans	-66.8	128.1	171.3	0	0	0	0	0	110.3	G44 V48	G44-A46 PolarHBondContact O-N 2.98Å; A46-V48 PolarHBondContact O-N 2.72Å
47	P	24.2	Very low	23.9	Very low	103 Å²	103	134.3 Å²	134.3	67%	0.669	73%	0.73	S	S	*	*	P	Polyproline II helix	trans	-63.6	131.9	173.1	-15.4	28.9	0	0	0	110.2
48	V	25.7	Very low	23.8	Very low	128 Å²	128	135 Å²	135	78%	0.776	73%	0.73	S	S	*	*	S	Bend	trans	-64.8	132	166.5	-176.1	0	0	0	0	106.3	A46	A46-V48 PolarHBondContact O-N 2.72Å
49	D	25.2	Very low	23.7	Very low	150 Å²	150	136 Å²	136	80%	0.802	74%	0.739	S	S	*	*			trans	105.7	40.3	174.8	-52.5	-27.6	0	0	0	119.1
50	L	24.6	Very low	23.5	Very low	110 Å²	110	133.6 Å²	133.6	58%	0.576	74%	0.738	S	S	*	*			trans	-126.9	119.5	167.9	-67.6	168.9	0	0	0	112	E54	L50-E54 WeakPolarHBondContact CD2-OE2 3.22Å
51	T	22.4	Very low	23.4	Very low	97 Å²	97	134.2 Å²	134.2	60%	0.595	74%	0.737	S	S	*	*			trans	-77.9	153.4	176.9	41.3	0	0	0	0	110.6	S53	T51-S53 PolarHBondContact O-N 2.91Å
52	P	22.7	Very low	23.4	Very low	139 Å²	139	134.7 Å²	134.7	90%	0.903	74%	0.736	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.7	16.5	-169.9	-18.7	32.9	0	0	0	116.6
53	S	22.8	Very low	23.3	Very low	98 Å²	98	131.8 Å²	131.8	69%	0.685	73%	0.733	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.1	5.4	-176.4	47.4	0	0	0	0	114.7	T51	T51-S53 PolarHBondContact O-N 2.91Å
54	E	23.1	Very low	23.2	Very low	132 Å²	132	128.7 Å²	128.7	62%	0.617	73%	0.725	S	S	*	*	S	Bend	trans	-116.6	11.6	-172.7	-67.8	-173.5	172.4	0	0	115.4	L50	L50-E54 WeakPolarHBondContact CD2-OE2 3.22Å
55	Y	24.5	Very low	23	Very low	182 Å²	182	136.5 Å²	136.5	71%	0.714	73%	0.733	S	S	*	*			trans	-116.1	90.2	170.9	-75.5	-84.7	0	0	0	111.3	F57	Y55-F57 HydrophobicContact CD1-CE2 4.18Å; Y55-F57 HydrophobicContact CG-CE2 4.39Å; Y55-F57 PolarHBondContact O-N 3Å
56	D	21.7	Very low	23	Very low	151 Å²	151	137.3 Å²	137.3	81%	0.807	73%	0.732	S	S	*	*			trans	-69.9	86.4	168.2	-90	-36.1	0	0	0	110.6	Q58	D56-Q58 PolarHBondContact O-N 2.98Å
57	F	22.6	Very low	23	Very low	179 Å²	179	137.8 Å²	137.8	79%	0.785	73%	0.73	S	S	*	*			trans	-86.9	91	158.6	-70.8	-81.2	0	0	0	108.7	Y55 V59	Y55-F57 HydrophobicContact CD1-CE2 4.18Å; Y55-F57 HydrophobicContact CG-CE2 4.39Å; Y55-F57 PolarHBondContact O-N 3Å; F57-V59 PolarHBondContact O-N 3.34Å
58	Q	21.8	Very low	23	Very low	138 Å²	138	142 Å²	142	65%	0.645	74%	0.741	S	S	*	*			trans	-84.2	108.5	172.7	-86.4	-169.6	12.1	0	0	111.9	D56 L60	D56-Q58 PolarHBondContact O-N 2.98Å; Q58-L60 PolarHBondContact O-N 3.4Å
59	V	22.6	Very low	23.1	Very low	137 Å²	137	145 Å²	145	83%	0.83	74%	0.743	S	S	*	*			trans	-69.7	112.2	165.8	178.3	0	0	0	0	109.4	F57 S61	F57-V59 PolarHBondContact O-N 3.34Å; V59-S61 PolarHBondContact O-N 3.16Å; V59-S61 VanDerWaalsContact O-N 3.08Å
60	L	21.5	Very low	23	Very low	112 Å²	112	141.2 Å²	141.2	59%	0.586	74%	0.74	S	S	*	*			trans	-67.9	98.5	172.5	-98.5	162.6	0	0	0	110.6	Q58 Q62 K86	Q58-L60 PolarHBondContact O-N 3.4Å; L60-Q62 PolarHBondContact O-N 2.94Å; L60-K86 HydrophobicContact CD1-CD 3.88Å; L60-K86 HydrophobicContact CD2-CD 4.05Å; L60-K86 HydrophobicContact CG-CD 4.35Å; L60-K86 VanDerWaalsContact CG-NZ 3.31Å
61	S	22	Very low	22.9	Very low	94 Å²	94	145.3 Å²	145.3	66%	0.657	75%	0.753	S	S	*	*			trans	-82.4	108	165.6	59.4	0	0	0	0	109.9	V59	V59-S61 PolarHBondContact O-N 3.16Å; V59-S61 VanDerWaalsContact O-N 3.08Å
62	Q	22.3	Very low	23	Very low	155 Å²	155	147.8 Å²	147.8	72%	0.724	76%	0.762	S	S	*	*			trans	-92.4	119.4	162.7	-84.6	-173	-6.7	0	0	109.1	L60	L60-Q62 PolarHBondContact O-N 2.94Å
63	S	21	Very low	23	Very low	114 Å²	114	148.8 Å²	148.8	80%	0.797	76%	0.759	S	S	*	*			trans	-87.1	123	172.3	41.8	0	0	0	0	109
64	V	22.8	Very low	23	Very low	111 Å²	111	150.8 Å²	150.8	67%	0.673	76%	0.76	S	S	*	*			trans	-117.1	114.3	170.2	-176.7	0	0	0	0	108.2	Y66	V64-Y66 HydrophobicContact CG1-CD2 4.38Å
65	R	22.1	Very low	22.9	Very low	236 Å²	236	151.1 Å²	151.1	89%	0.891	77%	0.766	S	S	*	*			trans	-77.8	114.8	169.3	-75.4	-178.3	174.7	178.3	-1.7	108.4
66	Y	23.8	Very low	23	Very low	227 Å²	227	146.1 Å²	146.1	89%	0.89	76%	0.755	S	S	*	*			trans	-84.7	114.6	166.5	-103.8	-90.9	0	0	0	109.3	V64	V64-Y66 HydrophobicContact CG1-CD2 4.38Å
67	S	23.7	Very low	23.2	Very low	101 Å²	101	150 Å²	150	71%	0.706	76%	0.759	S	S	*	*			trans	-94.8	118.3	169.5	163.7	0	0	0	0	109	K69	S67-K69 VanDerWaalsContact C-N 3.33Å; S67-K69 PolarHBondContact O-N 3Å
68	E	24.6	Very low	23.5	Very low	192 Å²	192	148.6 Å²	148.6	90%	0.897	76%	0.755	S	S	*	*	S	Bend	trans	-71	85	170.8	-78	-175.2	149.7	0	0	110.3
69	K	26.9	Very low	23.9	Very low	190 Å²	190	144.5 Å²	144.5	83%	0.826	74%	0.744	S	S	*	*	S	Bend	trans	-168.7	123.7	151.4	-102.7	156.7	-169.1	-173.9	0	107.4	S67	S67-K69 VanDerWaalsContact C-N 3.33Å; S67-K69 PolarHBondContact O-N 3Å
70	G	23.8	Very low	24.3	Very low	71 Å²	71	142 Å²	142	73%	0.732	73%	0.726	S	S	*	*			trans	-60	158.5	-171.3	0	0	0	0	0	113.6
71	K	22.5	Very low	25.1	Very low	196 Å²	196	141.8 Å²	141.8	85%	0.852	72%	0.722	S	S	*	*			trans	63.5	93.5	173.9	-55.3	177.6	179.5	-178.7	0	112.3
72	D	23.6	Very low	25.7	Very low	148 Å²	148	145.6 Å²	145.6	79%	0.791	72%	0.722	S	S	*	*				-168.6	134.4	124	-87.6	-25.8	0	0	0	111.5	I74	D72-I74 PolarHBondContact O-N 3.18Å
73	I	22.6	Very low	26.4	Very low	161 Å²	161	141.2 Å²	141.2	83%	0.826	70%	0.701	S	S	*	*			trans	-66.2	110.5	171.2	-65.7	158.3	0	0	0	106.2
74	I	23	Very low	27.5	Very low	139 Å²	139	141 Å²	141	71%	0.713	69%	0.685	S	S	*	*			trans	-126.5	96.8	168.5	-55.1	179.8	0	0	0	107.5	D72 P76	D72-I74 PolarHBondContact O-N 3.18Å; I74-P76 VanDerWaalsContact O-CD 3.22Å; I74-P76 WeakPolarHBondContact O-CD 3.37Å
75	L	22.4	Very low	28.5	Very low	140 Å²	140	139.7 Å²	139.7	73%	0.733	68%	0.675	S	S	*	*			trans	-66.4	108.7	158.5	-74.6	153.6	0	0	0	107.2	R77	L75-R77 PolarHBondContact O-N 3.3Å
76	P	25.2	Very low	29.4	Very low	77 Å²	77	131.2 Å²	131.2	50%	0.5	64%	0.644	S	S	.	*			trans	-84.2	108.8	173.4	7.6	12.3	0	0	0	107.1	I74 E78 A79	I74-P76 VanDerWaalsContact O-CD 3.22Å; I74-P76 WeakPolarHBondContact O-CD 3.37Å; P76-E78 PolarHBondContact O-N 2.89Å; P76-A79 PolarHBondContact O-N 2.89Å
77	R	27.3	Very low	30.2	Very low	232 Å²	232	123 Å²	123	88%	0.875	61%	0.614	S	S	*	*	H	α-helix	trans	-44.5	-19.4	167.5	-87.8	176.3	165.3	175.7	-5.1	114	L75 D80 Q81	L75-R77 PolarHBondContact O-N 3.3Å; R77-D80 PolarHBondContact O-N 3.24Å; R77-Q81 PolarHBondContact O-N 3.37Å
78	E	28.9	Very low	31.3	Very low	150 Å²	150	124 Å²	124	70%	0.701	61%	0.609	S	S	*	*	H	α-helix	trans	-73.2	-27.1	177.6	-67.1	177.4	159.2	0	0	114.3	P76 D80 R82	P76-E78 PolarHBondContact O-N 2.89Å; E78-D80 VanDerWaalsContact C-N 3.32Å; E78-R82 PolarHBondContact O-N 3.19Å
79	A	28.9	Very low	32.1	Very low	51 Å²	51	120.4 Å²	120.4	42%	0.421	59%	0.592	S	S	.	*	H	α-helix	trans	-69.6	-35.2	173.3	0	0	0	0	0	111.3	P76 F83	P76-A79 PolarHBondContact O-N 2.89Å; A79-F83 WeakPolarHBondContact O-CB 3.32Å; A79-F83 PolarHBondContact O-N 3.35Å; A79-F83 VanDerWaalsContact O-N 3.11Å
80	D	31.8	Very low	32.6	Very low	86 Å²	86	114.1 Å²	114.1	46%	0.46	57%	0.568	S	S	.	*	H	α-helix	trans	-70.5	-37	-179.9	-139.8	25.1	0	0	0	111.5	R77 E78 K84	R77-D80 PolarHBondContact O-N 3.24Å; E78-D80 VanDerWaalsContact C-N 3.32Å; D80-K84 WeakPolarHBondContact O-CG 3.46Å; D80-K84 PolarHBondContact O-N 3.43Å
81	Q	38.2	Very low	33.2	Very low	107 Å²	107	114.6 Å²	114.6	50%	0.5	56%	0.556	S	S	.	*	H	α-helix	trans	-71.7	-46.8	176.9	-161.1	68.2	29.8	0	0	112.2	R77 F83 K84 D85	R77-Q81 PolarHBondContact O-N 3.37Å; Q81-F83 PolarHBondContact O-N 3.31Å; Q81-K84 PolarHBondContact O-N 2.85Å; Q81-K84 VanDerWaalsContact O-N 3.09Å; Q81-D85 VanDerWaalsContact O-CG 3.26Å; Q81-D85 PolarHBondContact O-N 3.21Å
82	R	34.4	Very low	34.2	Very low	174 Å²	174	111.6 Å²	111.6	66%	0.657	55%	0.55	S	S	*	.	H	α-helix	trans	-61.6	-30.5	175.7	-74.2	-173.3	-176.4	-165.6	2	112.6	E78 K86	E78-R82 PolarHBondContact O-N 3.19Å; R82-K86 WeakPolarHBondContact O-CB 3.44Å; R82-K86 PolarHBondContact O-N 3.25Å; R82-K86 VanDerWaalsContact O-N 3.16Å
83	F	36.9	Very low	34.8	Very low	63 Å²	63	107.5 Å²	107.5	28%	0.276	53%	0.533	S	S	.	.	H	α-helix	trans	-69.8	-45.4	173.7	-164.7	-88.7	0	0	0	111.3	A79 Q81 D85 K86 Q87 L115	A79-F83 WeakPolarHBondContact O-CB 3.32Å; A79-F83 PolarHBondContact O-N 3.35Å; A79-F83 VanDerWaalsContact O-N 3.11Å; Q81-F83 PolarHBondContact O-N 3.31Å; F83-D85 PolarHBondContact O-N 3.28Å; F83-K86 PolarHBondContact O-N 3.11Å; F83-Q87 VanDerWaalsContact O-CB 3.32Å; F83-Q87 WeakPolarHBondContact O-CB 3.45Å; F83-Q87 PolarHBondContact O-N 2.84Å; F83-L115 HydrophobicContact CD1-CD2 4.2Å; F83-L115 HydrophobicContact CE1-CD2 3.22Å; F83-L115 HydrophobicContact CE2-CD2 4.05Å; F83-L115 HydrophobicContact CZ-CD2 3.13Å
84	K	43.7	Very low	35.3	Very low	108 Å²	108	111.5 Å²	111.5	47%	0.47	54%	0.537	S	S	.	.	H	α-helix	trans	-60.9	-40.8	174.5	-75.2	176.1	-177.1	176.7	0	112.9	D80 Q81 Q87 M88	D80-K84 WeakPolarHBondContact O-CG 3.46Å; D80-K84 PolarHBondContact O-N 3.43Å; Q81-K84 PolarHBondContact O-N 2.85Å; Q81-K84 VanDerWaalsContact O-N 3.09Å; K84-Q87 PolarHBondContact O-N 3.47Å; K84-M88 PolarHBondContact O-N 3.16Å
85	D	45.2	Very low	35.7	Very low	85 Å²	85	109.5 Å²	109.5	46%	0.455	53%	0.528	S	S	.	.	H	α-helix	trans	-64.9	-42.9	178.1	-63.3	-22.6	0	0	0	110.9	Q81 F83 M88 E89	Q81-D85 VanDerWaalsContact O-CG 3.26Å; Q81-D85 PolarHBondContact O-N 3.21Å; F83-D85 PolarHBondContact O-N 3.28Å; D85-M88 PolarHBondContact O-N 2.82Å; D85-E89 WeakPolarHBondContact O-CB 3.44Å; D85-E89 PolarHBondContact O-N 3.34Å
86	K	40.6	Very low	36.2	Very low	58 Å²	58	106 Å²	106	25%	0.252	52%	0.515	S	S	.	.	H	α-helix	trans	-69.1	-33.6	174.4	-82.4	-179.8	169.8	-100.2	0	113.6	L60 R82 F83 E89 L90	L60-K86 HydrophobicContact CD1-CD 3.88Å; L60-K86 HydrophobicContact CD2-CD 4.05Å; L60-K86 HydrophobicContact CG-CD 4.35Å; L60-K86 VanDerWaalsContact CG-NZ 3.31Å; R82-K86 WeakPolarHBondContact O-CB 3.44Å; R82-K86 PolarHBondContact O-N 3.25Å; R82-K86 VanDerWaalsContact O-N 3.16Å; F83-K86 PolarHBondContact O-N 3.11Å; K86-E89 WeakPolarHBondContact O-CB 3.36Å; K86-E89 PolarHBondContact O-N 2.94Å; K86-L90 WeakPolarHBondContact O-CB 3.06Å; K86-L90 WeakPolarHBondContact O-CD1 3.27Å; K86-L90 VanDerWaalsContact O-CG 3.29Å; K86-L90 WeakPolarHBondContact O-CG 3.39Å; K86-L90 PolarHBondContact O-N 2.9Å
87	Q	40.7	Very low	36.3	Very low	54 Å²	54	105.5 Å²	105.5	25%	0.252	51%	0.511	S	S	.	.	H	α-helix	trans	-65.8	-41.7	174.2	-155.8	175.8	24.7	0	0	110	F83 K84 L90 T91	F83-Q87 VanDerWaalsContact O-CB 3.32Å; F83-Q87 WeakPolarHBondContact O-CB 3.45Å; F83-Q87 PolarHBondContact O-N 2.84Å; K84-Q87 PolarHBondContact O-N 3.47Å; Q87-L90 PolarHBondContact O-N 3.25Å; Q87-T91 WeakPolarHBondContact O-CB 3.33Å; Q87-T91 PolarHBondContact O-N 3.09Å; Q87-T91 PolarHBondContact O-OG1 3.33Å
88	M	45.3	Very low	36.6	Very low	123 Å²	123	98.4 Å²	98.4	61%	0.606	50%	0.503	S	S	*	.	H	α-helix	trans	-62.7	-40	171.4	-78.8	-129	-71	0	0	112.6	K84 D85 T91 N92	K84-M88 PolarHBondContact O-N 3.16Å; D85-M88 PolarHBondContact O-N 2.82Å; M88-T91 PolarHBondContact O-N 3.32Å; M88-N92 WeakPolarHBondContact O-CB 3.38Å; M88-N92 PolarHBondContact O-N 2.97Å; M88-N92 PolarHBondContact O-ND2 3.25Å
89	E	43.4	Very low	36.8	Very low	116 Å²	116	95.6 Å²	95.6	54%	0.542	49%	0.488	S	S	.	.	H	α-helix	trans	-63.3	-39.8	175.3	-159	174.8	-157.2	0	0	112.4	D85 K86 N92 S93	D85-E89 WeakPolarHBondContact O-CB 3.44Å; D85-E89 PolarHBondContact O-N 3.34Å; K86-E89 WeakPolarHBondContact O-CB 3.36Å; K86-E89 PolarHBondContact O-N 2.94Å; E89-N92 PolarHBondContact O-N 3.35Å; E89-S93 PolarHBondContact O-N 2.58Å; E89-S93 VanDerWaalsContact O-N 3.14Å; E89-S93 PolarHBondContact O-OG 2.85Å
90	L	37.5	Very low	37	Very low	58 Å²	58	94.7 Å²	94.7	30%	0.304	48%	0.475	S	S	.	.	H	α-helix	trans	-68.7	-36.3	172.9	-75.2	162	0	0	0	112.5	K86 Q87 N92 S93 L95 M140	K86-L90 WeakPolarHBondContact O-CB 3.06Å; K86-L90 WeakPolarHBondContact O-CD1 3.27Å; K86-L90 VanDerWaalsContact O-CG 3.29Å; K86-L90 WeakPolarHBondContact O-CG 3.39Å; K86-L90 PolarHBondContact O-N 2.9Å; Q87-L90 PolarHBondContact O-N 3.25Å; L90-N92 VanDerWaalsContact C-N 3.34Å; L90-S93 WeakPolarHBondContact CA-OG 3.45Å; L90-S93 PolarHBondContact O-N 3.32Å; L90-S93 PolarHBondContact O-OG 2.86Å; L90-L95 HydrophobicContact CD2-CD1 3.97Å; L90-M140 HydrophobicContact CD2-CE 4.33Å; L90-M140 HydrophobicContact CD2-SD 4.17Å
91	T	35.6	Very low	37.2	Very low	81 Å²	81	90.9 Å²	90.9	50%	0.497	46%	0.455	S	S	.	.	H	α-helix	trans	-70.1	-34.3	176.8	-42	0	0	0	0	111	Q87 M88	Q87-T91 WeakPolarHBondContact O-CB 3.33Å; Q87-T91 PolarHBondContact O-N 3.09Å; Q87-T91 PolarHBondContact O-OG1 3.33Å; M88-T91 PolarHBondContact O-N 3.32Å
92	N	43.9	Very low	36.8	Very low	133 Å²	133	85.8 Å²	85.8	71%	0.711	43%	0.431	S	S	*	.	H	α-helix	trans	-76.3	-21.5	177.1	-72	-23.3	0	0	0	113.6	M88 E89 L90 R94	M88-N92 WeakPolarHBondContact O-CB 3.38Å; M88-N92 PolarHBondContact O-N 2.97Å; M88-N92 PolarHBondContact O-ND2 3.25Å; E89-N92 PolarHBondContact O-N 3.35Å; L90-N92 VanDerWaalsContact C-N 3.34Å; N92-R94 PolarHBondContact O-N 3.26Å
93	S	35.6	Very low	36.9	Very low	62 Å²	62	78.9 Å²	78.9	43%	0.434	41%	0.407	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.1	16.8	179.1	41.1	0	0	0	0	114.1	E89 L90 L95	E89-S93 PolarHBondContact O-N 2.58Å; E89-S93 VanDerWaalsContact O-N 3.14Å; E89-S93 PolarHBondContact O-OG 2.85Å; L90-S93 WeakPolarHBondContact CA-OG 3.45Å; L90-S93 PolarHBondContact O-N 3.32Å; L90-S93 PolarHBondContact O-OG 2.86Å; S93-L95 PolarHBondContact O-N 2.9Å
94	R	33	Very low	36.6	Very low	244 Å²	244	77.1 Å²	77.1	92%	0.921	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.2	14.1	-177.4	-62.2	-175.7	175.9	-168.8	-0.4	114.3	N92 S96	N92-R94 PolarHBondContact O-N 3.26Å; R94-S96 PolarHBondContact O-N 3.28Å
95	L	31.3	Very low	36	Very low	98 Å²	98	72.4 Å²	72.4	51%	0.513	38%	0.382	S	S	.	.			trans	-78.6	115.1	173.1	-72.7	164	0	0	0	108.3	L90 S93 P97	L90-L95 HydrophobicContact CD2-CD1 3.97Å; S93-L95 PolarHBondContact O-N 2.9Å; L95-P97 WeakPolarHBondContact O-CD 3.38Å
96	S	32.2	Very low	35.2	Very low	67 Å²	67	70.6 Å²	70.6	47%	0.469	38%	0.376	S	S	.	.			trans	-63.1	123.1	-178	173.7	0	0	0	0	111	R94 A98 K99	R94-S96 PolarHBondContact O-N 3.28Å; S96-A98 PolarHBondContact O-N 3.22Å; S96-A98 WeakPolarHBondContact OG-CB 3.42Å; S96-A98 PolarHBondContact OG-N 3.41Å; S96-K99 PolarHBondContact O-N 2.94Å
97	P	29.1	Very low	34.8	Very low	65 Å²	65	71.8 Å²	71.8	42%	0.422	38%	0.383	S	S	.	.	G	3₁₀ helix	trans	-57.8	-16.6	174.8	-22.7	31.9	0	0	0	113.9	L95 K99 H116	L95-P97 WeakPolarHBondContact O-CD 3.38Å; P97-K99 PolarHBondContact O-N 3.42Å; P97-H116 HydrophobicContact CB-CB 4.46Å
98	A	31.9	Very low	34.5	Very low	84 Å²	84	74.4 Å²	74.4	69%	0.694	41%	0.407	S	S	*	.	G	3₁₀ helix	trans	-73.5	-12.7	178.3	0	0	0	0	0	113.6	S96	S96-A98 PolarHBondContact O-N 3.22Å; S96-A98 WeakPolarHBondContact OG-CB 3.42Å; S96-A98 PolarHBondContact OG-N 3.41Å
99	K	34.5	Very low	34	Very low	90 Å²	90	70.4 Å²	70.4	39%	0.391	40%	0.397	S	S	.	.	G	3₁₀ helix	trans	-105.4	23.3	-178.6	-68.7	-173.2	171.1	-170.6	0	113	S96 P97 D138 E139 M140	S96-K99 PolarHBondContact O-N 2.94Å; P97-K99 PolarHBondContact O-N 3.42Å; K99-D138 HydrophobicContact CD-CB 4.18Å; K99-D138 IonicContact NZ-OD2 2.79Å; K99-D138 PolarHBondContact NZ-OD2 2.9Å; K99-E139 HydrophobicContact CB-CG 4.28Å; K99-E139 CarbonylContact O-C 3.55Å; K99-E139 VanDerWaalsContact O-CA 3.25Å; K99-E139 WeakPolarHBondContact O-CA 3.43Å; K99-M140 PolarHBondContact O-N 3.05Å
100	H	32.8	Very low	33.7	Very low	32 Å²	32	68.8 Å²	68.8	15%	0.148	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	123	-176.6	-166.7	-106	0	0	0	111.3	G117 M140 T142	H100-G117 WeakPolarHBondContact O-CA 3.49Å; H100-M140 CarbonylContact C-O 3.44Å; H100-M140 WeakPolarHBondContact CA-O 3.27Å; H100-T142 PolarHBondContact CE1-OG1 3.24Å; H100-T142 VanDerWaalsContact CE1-OG1 3.31Å; H100-T142 PolarHBondContact NE2-OG1 3.33Å
101	I	35.2	Very low	34	Very low	7 Å²	7	76.1 Å²	76.1	4%	0.036	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	132.7	174.3	-64.9	164.2	0	0	0	108.2	I103 Y120 L134 E139 M140 V141 T142	I101-I103 HydrophobicContact CG2-CG1 4.07Å; I101-Y120 HydrophobicContact CG1-CE2 4.45Å; I101-Y120 HydrophobicContact CG2-CD2 3.49Å; I101-Y120 VanDerWaalsContact CG2-CD2 3.49Å; I101-Y120 HydrophobicContact CG2-CE2 3.64Å; I101-L134 HydrophobicContact CD1-CD1 3.54Å; I101-L134 HydrophobicContact CD1-CD2 4.11Å; I101-L134 HydrophobicContact CD1-CG 4.33Å; I101-L134 HydrophobicContact CG1-CD1 4.42Å; I101-E139 HydrophobicContact CD1-CB 3.95Å; I101-E139 WeakPolarHBondContact CD1-OE2 3.41Å; I101-E139 HydrophobicContact CG1-CB 4.42Å; I101-M140 PolarHBondContact N-O 3.43Å; I101-V141 HydrophobicContact CB-CG2 4.27Å; I101-V141 HydrophobicContact CD1-CG2 4.12Å; I101-V141 CarbonylContact O-C 3.47Å; I101-V141 WeakPolarHBondContact O-CA 3.12Å; I101-T142 PolarHBondContact O-N 3.21Å
102	T	31.4	Very low	34.4	Very low	0 Å²	0	75.9 Å²	75.9	0%	0	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	123.8	171.8	-53.3	0	0	0	0	111.1	L104 L115 K118 E119 Y120 T142 L144	T102-L104 HydrophobicContact CG2-CD2 4.23Å; T102-L115 HydrophobicContact CG2-CD1 3.4Å; T102-K118 PolarHBondContact N-O 2.77Å; T102-E119 WeakPolarHBondContact O-CA 3.5Å; T102-Y120 PolarHBondContact O-N 2.74Å; T102-T142 CarbonylContact C-O 3.47Å; T102-T142 WeakPolarHBondContact CA-O 3.16Å; T102-L144 HydrophobicContact CG2-CD1 3.42Å; T102-L144 VanDerWaalsContact CG2-CD1 3.42Å; T102-L144 HydrophobicContact CG2-CG 3.76Å
103	I	35.7	Very low	34.2	Very low	29 Å²	29	78.6 Å²	78.6	15%	0.149	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	119.4	-179.9	-56.7	-178.6	0	0	0	109.7	I101 Y120 V122 L131 V141 T142 V143 L144	I101-I103 HydrophobicContact CG2-CG1 4.07Å; I103-Y120 WeakPolarHBondContact CA-O 3.33Å; I103-V122 HydrophobicContact CG2-CG2 3.45Å; I103-V122 VanDerWaalsContact CG2-CG2 3.45Å; I103-L131 HydrophobicContact CD1-CD2 3.92Å; I103-L131 HydrophobicContact CG1-CD2 4.25Å; I103-V141 HydrophobicContact CD1-CG1 3.43Å; I103-V141 VanDerWaalsContact CD1-CG1 3.43Å; I103-V141 HydrophobicContact CG1-CG1 3.87Å; I103-T142 PolarHBondContact N-O 2.88Å; I103-V143 HydrophobicContact CB-CG1 4.43Å; I103-V143 HydrophobicContact CB-CG2 4.22Å; I103-V143 HydrophobicContact CD1-CG2 4.47Å; I103-V143 CarbonylContact O-C 3.57Å; I103-V143 VanDerWaalsContact O-CA 3.32Å; I103-V143 WeakPolarHBondContact O-CA 3.22Å; I103-L144 PolarHBondContact O-N 3.44Å
104	L	30.7	Very low	34.5	Very low	25 Å²	25	83.3 Å²	83.3	13%	0.131	43%	0.434	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	112.7	-179.5	-56.9	-179.1	0	0	0	111.5	T102 S106 Y120 L144	T102-L104 HydrophobicContact CG2-CD2 4.23Å; L104-S106 PolarHBondContact O-N 2.75Å; L104-Y120 PolarHBondContact N-O 2.79Å; L104-L144 CarbonylContact C-O 3.55Å; L104-L144 VanDerWaalsContact CA-O 3.28Å; L104-L144 WeakPolarHBondContact CA-O 3.34Å; L104-L144 HydrophobicContact CD2-CB 3.82Å; L104-L144 HydrophobicContact CD2-CD1 4.03Å; L104-L144 HydrophobicContact CD2-CG 4.45Å
105	G	29.8	Very low	35	Very low	10 Å²	10	73 Å²	73	10%	0.103	40%	0.396	C	S	.	.			trans	-86.2	18.8	-175.8	0	0	0	0	0	115.8	L144 G147	G105-L144 PolarHBondContact N-O 2.75Å; G105-G147 CarbonylContact O-C 3.36Å; G105-G147 WeakPolarHBondContact O-CA 3.5Å; G105-G147 PolarHBondContact O-N 3.31Å
106	S	29	Very low	35.4	Very low	46 Å²	46	74.3 Å²	74.3	32%	0.322	40%	0.4	S	S	.	.	S	Bend	trans	-153.3	144.6	169.8	94	0	0	0	0	113.2	L104 S108	L104-S106 PolarHBondContact O-N 2.75Å; S106-S108 PolarHBondContact O-N 3.41Å
107	E	32.2	Very low	36.1	Very low	84 Å²	84	72.9 Å²	72.9	39%	0.393	40%	0.396	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-1.4	-178.6	-62.8	-166.8	110.1	0	0	115.2	S150	E107-S150 WeakPolarHBondContact OE2-CB 3.33Å; E107-S150 PolarHBondContact OE2-OG 3.06Å
108	S	33.7	Very low	37.1	Very low	108 Å²	108	75.9 Å²	75.9	76%	0.755	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-133.3	7.8	-168.7	58.5	0	0	0	0	115	S106	S106-S108 PolarHBondContact O-N 3.41Å
109	G	36.1	Very low	37.8	Very low	39 Å²	39	74.5 Å²	74.5	40%	0.402	38%	0.382	S	S	.	.	S	Bend	trans	-75.6	139.3	172.6	0	0	0	0	0	111.5	R111	G109-R111 PolarHBondContact O-N 2.81Å
110	P	37	Very low	38.4	Very low	82 Å²	82	70.5 Å²	70.5	53%	0.532	36%	0.364	S	S	.	.	P	Polyproline II helix	trans	-57	130.1	170.1	24.3	-31.3	0	0	0	109.2	H112	P110-H112 PolarHBondContact O-CD2 3Å; P110-H112 PolarHBondContact O-N 2.79Å; P110-H112 VanDerWaalsContact O-N 3.1Å
111	R	43.6	Very low	38.9	Very low	213 Å²	213	70.4 Å²	70.4	80%	0.804	37%	0.369	S	S	*	.	P	Polyproline II helix	trans	-53.5	119.7	169.2	-73.9	-173.9	177.5	-174.7	-1.7	108	G109 K113	G109-R111 PolarHBondContact O-N 2.81Å; R111-K113 VanDerWaalsContact C-N 3.32Å; R111-K113 PolarHBondContact O-N 2.78Å
112	H	44.1	Very low	39.1	Very low	75 Å²	75	72.2 Å²	72.2	35%	0.347	38%	0.38	S	S	.	.			trans	-81.9	83.2	-174.6	-66.7	-75.3	0	0	0	109	P110 H114 L115 E119	P110-H112 PolarHBondContact O-CD2 3Å; P110-H112 PolarHBondContact O-N 2.79Å; P110-H112 VanDerWaalsContact O-N 3.1Å; H112-H114 PolarHBondContact O-N 3.05Å; H112-L115 HydrophobicContact CB-CD1 3.59Å; H112-L115 HydrophobicContact CB-CG 3.65Å; H112-L115 PolarHBondContact O-N 2.79Å; H112-L115 VanDerWaalsContact O-N 3.1Å; H112-E119 WeakPolarHBondContact CB-OE1 3.46Å
113	K	38.9	Very low	39.5	Very low	190 Å²	190	76.3 Å²	76.3	83%	0.826	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.6	0.1	177.1	-72.7	-173.9	176.2	-177.7	0	115.9	R111	R111-K113 VanDerWaalsContact C-N 3.32Å; R111-K113 PolarHBondContact O-N 2.78Å
114	H	42.8	Very low	39.8	Very low	162 Å²	162	77.4 Å²	77.4	75%	0.75	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119.6	5.5	-174.8	-58	-53.5	0	0	0	113.8	H112	H112-H114 PolarHBondContact O-N 3.05Å
115	L	42.5	Very low	39.9	Very low	26 Å²	26	84.2 Å²	84.2	14%	0.136	43%	0.432	C	S	.	.			trans	-82.8	121.8	174.4	-64.7	-179.8	0	0	0	110.5	F83 T102 H112 G117 E119 L144	F83-L115 HydrophobicContact CD1-CD2 4.2Å; F83-L115 HydrophobicContact CE1-CD2 3.22Å; F83-L115 HydrophobicContact CE2-CD2 4.05Å; F83-L115 HydrophobicContact CZ-CD2 3.13Å; T102-L115 HydrophobicContact CG2-CD1 3.4Å; H112-L115 HydrophobicContact CB-CD1 3.59Å; H112-L115 HydrophobicContact CB-CG 3.65Å; H112-L115 PolarHBondContact O-N 2.79Å; H112-L115 VanDerWaalsContact O-N 3.1Å; L115-G117 PolarHBondContact O-N 2.9Å; L115-E119 HydrophobicContact CB-CG 4.49Å; L115-E119 WeakPolarHBondContact CD1-OE1 3.45Å; L115-L144 HydrophobicContact CD1-CD1 3.67Å
116	H	40.7	Very low	40.4	Very low	126 Å²	126	89.3 Å²	89.3	58%	0.583	45%	0.453	S	S	*	.	S	Bend	trans	-69.9	123.9	164.3	-81.7	-77.3	0	0	0	108.5	P97	P97-H116 HydrophobicContact CB-CB 4.46Å
117	G	47	Very low	41.3	Very low	38 Å²	38	89.2 Å²	89.2	39%	0.392	45%	0.448	S	S	.	.	S	Bend	trans	131	174.8	-178.3	0	0	0	0	0	113.3	H100 L115	H100-G117 WeakPolarHBondContact O-CA 3.49Å; L115-G117 PolarHBondContact O-N 2.9Å
118	K	49.8	Very low	41.5	Very low	127 Å²	127	89.9 Å²	89.9	55%	0.552	45%	0.451	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.8	126.9	168.6	-71	-172.5	180	-176.1	0	109.1	T102 Y120	T102-K118 PolarHBondContact N-O 2.77Å; K118-Y120 HydrophobicContact CB-CD2 4.35Å; K118-Y120 HydrophobicContact CB-CE2 3.59Å; K118-Y120 HydrophobicContact CD-CE2 4.39Å; K118-Y120 VanDerWaalsContact CD-OH 3.27Å; K118-Y120 WeakPolarHBondContact CD-OH 3.29Å
119	E	47.4	Very low	41.9	Very low	56 Å²	56	91.2 Å²	91.2	26%	0.262	45%	0.445	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	126.7	173.1	-64.2	-167.4	141.6	0	0	110.4	T102 H112 L115	T102-E119 WeakPolarHBondContact O-CA 3.5Å; H112-E119 WeakPolarHBondContact CB-OE1 3.46Å; L115-E119 HydrophobicContact CB-CG 4.49Å; L115-E119 WeakPolarHBondContact CD1-OE1 3.45Å
120	Y	46.7	Very low	42.4	Very low	5 Å²	5	94 Å²	94	2%	0.02	45%	0.448	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	133.2	174.8	-63	-87.2	0	0	0	110.9	I101 T102 I103 L104 K118 Q127 E130 L131 L134	I101-Y120 HydrophobicContact CG1-CE2 4.45Å; I101-Y120 HydrophobicContact CG2-CD2 3.49Å; I101-Y120 VanDerWaalsContact CG2-CD2 3.49Å; I101-Y120 HydrophobicContact CG2-CE2 3.64Å; T102-Y120 PolarHBondContact O-N 2.74Å; I103-Y120 WeakPolarHBondContact CA-O 3.33Å; L104-Y120 PolarHBondContact N-O 2.79Å; K118-Y120 HydrophobicContact CB-CD2 4.35Å; K118-Y120 HydrophobicContact CB-CE2 3.59Å; K118-Y120 HydrophobicContact CD-CE2 4.39Å; K118-Y120 VanDerWaalsContact CD-OH 3.27Å; K118-Y120 WeakPolarHBondContact CD-OH 3.29Å; Y120-Q127 HydrophobicContact CD1-CB 4.02Å; Y120-Q127 HydrophobicContact CD1-CG 4.23Å; Y120-E130 HydrophobicContact CE1-CB 3.9Å; Y120-L131 HydrophobicContact CD1-CD1 4.16Å; Y120-L131 HydrophobicContact CD1-CD2 4.01Å; Y120-L131 HydrophobicContact CD1-CG 3.65Å; Y120-L131 HydrophobicContact CD2-CD2 3.68Å; Y120-L131 HydrophobicContact CD2-CG 4.26Å; Y120-L131 HydrophobicContact CE1-CD2 4.42Å; Y120-L131 HydrophobicContact CE1-CG 4.12Å; Y120-L131 HydrophobicContact CE2-CD2 4.11Å; Y120-L131 HydrophobicContact CG-CD1 4.07Å; Y120-L131 HydrophobicContact CG-CD2 3.61Å; Y120-L131 HydrophobicContact CG-CG 3.71Å; Y120-L134 HydrophobicContact CE2-CD1 3.8Å; Y120-L134 WeakPolarHBondContact OH-CD1 3.38Å
121	A	43.1	Very low	42.8	Very low	30 Å²	30	92.4 Å²	92.4	25%	0.248	43%	0.434	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	121.1	172.1	0	0	0	0	0	108.6	N123 N124 Q127	A121-N123 VanDerWaalsContact CB-OD1 3.27Å; A121-N123 WeakPolarHBondContact CB-OD1 3.45Å; A121-N123 PolarHBondContact O-N 3Å; A121-N124 PolarHBondContact O-N 2.82Å; A121-Q127 PolarHBondContact O-OE1 3.19Å
122	V	40.1	Very low	42.5	Very low	46 Å²	46	89.5 Å²	89.5	28%	0.279	43%	0.434	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-10.3	-171.9	-167.4	0	0	0	0	112.8	I103 V149	I103-V122 HydrophobicContact CG2-CG2 3.45Å; I103-V122 VanDerWaalsContact CG2-CG2 3.45Å; V122-V149 HydrophobicContact CB-CG2 4.08Å; V122-V149 HydrophobicContact CG1-CG2 3.9Å
123	N	38.9	Very low	42.5	Very low	85 Å²	85	89.8 Å²	89.8	46%	0.455	45%	0.445	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.9	-1.9	176.6	61	-7.8	0	0	0	114.8	A121	A121-N123 VanDerWaalsContact CB-OD1 3.27Å; A121-N123 WeakPolarHBondContact CB-OD1 3.45Å; A121-N123 PolarHBondContact O-N 3Å
124	N	42.6	Very low	42.8	Very low	52 Å²	52	82.8 Å²	82.8	28%	0.278	42%	0.416	S	S	.	.			trans	-96.5	103.6	173.7	-170.3	-0.5	0	0	0	110.2	A121 Q126 Q127 Q128	A121-N124 PolarHBondContact O-N 2.82Å; N124-Q126 PolarHBondContact O-N 2.97Å; N124-Q126 PolarHBondContact OD1-N 3.45Å; N124-Q127 HydrophobicContact CB-CB 4.03Å; N124-Q127 HydrophobicContact CB-CG 4.04Å; N124-Q127 WeakPolarHBondContact O-CA 3.49Å; N124-Q127 WeakPolarHBondContact O-CB 3.38Å; N124-Q127 PolarHBondContact O-N 2.86Å; N124-Q128 PolarHBondContact O-N 3.14Å
125	W	33	Very low	42.5	Very low	168 Å²	168	81.7 Å²	81.7	64%	0.636	42%	0.416	S	S	*	.	H	α-helix	trans	-57.9	-31.4	-177.7	71.7	-85.1	0	0	0	113.1	Q127 Q128	W125-Q127 PolarHBondContact O-N 3.01Å; W125-Q128 WeakPolarHBondContact O-CB 3.28Å; W125-Q128 PolarHBondContact O-N 3.13Å
126	Q	39	Very low	42.4	Very low	117 Å²	117	86.8 Å²	86.8	55%	0.547	44%	0.437	S	S	.	.	H	α-helix	trans	-66.9	-27.1	175.4	-65.5	177	-34.2	0	0	112.2	N124	N124-Q126 PolarHBondContact O-N 2.97Å; N124-Q126 PolarHBondContact OD1-N 3.45Å
127	Q	47.3	Very low	41.9	Very low	45 Å²	45	85 Å²	85	21%	0.21	43%	0.431	C	S	.	.	H	α-helix	trans	-85.3	-16.5	177.7	-76.3	-178	-14.6	0	0	113	Y120 A121 N124 W125 E130 L131	Y120-Q127 HydrophobicContact CD1-CB 4.02Å; Y120-Q127 HydrophobicContact CD1-CG 4.23Å; A121-Q127 PolarHBondContact O-OE1 3.19Å; N124-Q127 HydrophobicContact CB-CB 4.03Å; N124-Q127 HydrophobicContact CB-CG 4.04Å; N124-Q127 WeakPolarHBondContact O-CA 3.49Å; N124-Q127 WeakPolarHBondContact O-CB 3.38Å; N124-Q127 PolarHBondContact O-N 2.86Å; W125-Q127 PolarHBondContact O-N 3.01Å; Q127-E130 PolarHBondContact O-N 3.33Å; Q127-L131 WeakPolarHBondContact O-CB 3.21Å; Q127-L131 WeakPolarHBondContact O-CG 3.09Å; Q127-L131 PolarHBondContact O-N 2.98Å
128	Q	37.7	Very low	41.2	Very low	98 Å²	98	88.3 Å²	88.3	46%	0.458	44%	0.44	S	S	.	.	H	α-helix	trans	-67.2	-41.3	173.7	-79.3	-178.4	-33	0	0	111.3	N124 W125 L131 L132	N124-Q128 PolarHBondContact O-N 3.14Å; W125-Q128 WeakPolarHBondContact O-CB 3.28Å; W125-Q128 PolarHBondContact O-N 3.13Å; Q128-L131 PolarHBondContact O-N 3.14Å; Q128-L132 WeakPolarHBondContact O-CB 3.2Å; Q128-L132 WeakPolarHBondContact O-CD1 3.42Å; Q128-L132 WeakPolarHBondContact O-CG 3.44Å; Q128-L132 PolarHBondContact O-N 3.21Å
129	E	41.5	Very low	40.7	Very low	136 Å²	136	84.6 Å²	84.6	64%	0.636	42%	0.424	S	S	*	.	H	α-helix	trans	-65	-39.6	173.8	-72	-176.7	169.9	0	0	111.3	L132 S133	E129-L132 PolarHBondContact O-N 2.89Å; E129-S133 WeakPolarHBondContact O-CB 3.32Å; E129-S133 PolarHBondContact O-N 3.4Å; E129-S133 PolarHBondContact O-OG 3.45Å
130	E	47.4	Very low	39.9	Very low	97 Å²	97	86.6 Å²	86.6	45%	0.453	44%	0.435	S	S	.	.	H	α-helix	trans	-62.8	-42.4	173.5	-76.1	-171.1	163.5	0	0	112.5	Y120 Q127 L132 S133 L134	Y120-E130 HydrophobicContact CE1-CB 3.9Å; Q127-E130 PolarHBondContact O-N 3.33Å; E130-L132 VanDerWaalsContact C-N 3.35Å; E130-S133 WeakPolarHBondContact CA-OG 3.48Å; E130-S133 PolarHBondContact O-N 3.08Å; E130-S133 PolarHBondContact O-OG 3.36Å; E130-L134 WeakPolarHBondContact O-CG 3.25Å; E130-L134 PolarHBondContact O-N 3.3Å
131	L	44.5	Very low	39.5	Very low	48 Å²	48	90 Å²	90	25%	0.251	46%	0.456	S	S	.	.	H	α-helix	trans	-64.3	-36.1	175	-82.1	165.4	0	0	0	112.9	I103 Y120 Q127 Q128 L134	I103-L131 HydrophobicContact CD1-CD2 3.92Å; I103-L131 HydrophobicContact CG1-CD2 4.25Å; Y120-L131 HydrophobicContact CD1-CD1 4.16Å; Y120-L131 HydrophobicContact CD1-CD2 4.01Å; Y120-L131 HydrophobicContact CD1-CG 3.65Å; Y120-L131 HydrophobicContact CD2-CD2 3.68Å; Y120-L131 HydrophobicContact CD2-CG 4.26Å; Y120-L131 HydrophobicContact CE1-CD2 4.42Å; Y120-L131 HydrophobicContact CE1-CG 4.12Å; Y120-L131 HydrophobicContact CE2-CD2 4.11Å; Y120-L131 HydrophobicContact CG-CD1 4.07Å; Y120-L131 HydrophobicContact CG-CD2 3.61Å; Y120-L131 HydrophobicContact CG-CG 3.71Å; Q127-L131 WeakPolarHBondContact O-CB 3.21Å; Q127-L131 WeakPolarHBondContact O-CG 3.09Å; Q127-L131 PolarHBondContact O-N 2.98Å; Q128-L131 PolarHBondContact O-N 3.14Å; L131-L134 HydrophobicContact CD2-CD1 4.16Å
132	L	38.5	Very low	39.1	Very low	153 Å²	153	90.2 Å²	90.2	80%	0.801	45%	0.454	S	S	*	.	H	α-helix	trans	-78.7	-22.3	176.8	-69.2	165.7	0	0	0	112.3	Q128 E129 E130	Q128-L132 WeakPolarHBondContact O-CB 3.2Å; Q128-L132 WeakPolarHBondContact O-CD1 3.42Å; Q128-L132 WeakPolarHBondContact O-CG 3.44Å; Q128-L132 PolarHBondContact O-N 3.21Å; E129-L132 PolarHBondContact O-N 2.89Å; E130-L132 VanDerWaalsContact C-N 3.35Å
133	S	42.5	Very low	39	Very low	81 Å²	81	92.6 Å²	92.6	57%	0.566	47%	0.468	S	S	*	.	S	Bend	trans	-90	-1.1	176.1	74.8	0	0	0	0	114.3	E129 E130 D135	E129-S133 WeakPolarHBondContact O-CB 3.32Å; E129-S133 PolarHBondContact O-N 3.4Å; E129-S133 PolarHBondContact O-OG 3.45Å; E130-S133 WeakPolarHBondContact CA-OG 3.48Å; E130-S133 PolarHBondContact O-N 3.08Å; E130-S133 PolarHBondContact O-OG 3.36Å; S133-D135 PolarHBondContact O-N 3.04Å
134	L	45.2	Very low	38.7	Very low	43 Å²	43	91.1 Å²	91.1	23%	0.225	46%	0.46	C	S	.	.			trans	-72.9	75.5	176.3	-86.4	162.3	0	0	0	110	I101 Y120 E130 L131 K136 E139	I101-L134 HydrophobicContact CD1-CD1 3.54Å; I101-L134 HydrophobicContact CD1-CD2 4.11Å; I101-L134 HydrophobicContact CD1-CG 4.33Å; I101-L134 HydrophobicContact CG1-CD1 4.42Å; Y120-L134 HydrophobicContact CE2-CD1 3.8Å; Y120-L134 WeakPolarHBondContact OH-CD1 3.38Å; E130-L134 WeakPolarHBondContact O-CG 3.25Å; E130-L134 PolarHBondContact O-N 3.3Å; L131-L134 HydrophobicContact CD2-CD1 4.16Å; L134-K136 PolarHBondContact O-N 3.1Å; L134-E139 WeakPolarHBondContact CD2-OE2 3.19Å
135	D	36.8	Very low	38.1	Very low	138 Å²	138	90.6 Å²	90.6	74%	0.738	47%	0.467	S	S	*	.			trans	-78.9	29.9	-178.9	-133.7	4.5	0	0	0	112.5	S133	S133-D135 PolarHBondContact O-N 3.04Å
136	K	40.4	Very low	37.8	Very low	134 Å²	134	90.2 Å²	90.2	58%	0.583	48%	0.478	S	S	*	.			trans	-117.2	82.4	-169	-66.3	-176.8	-179.6	-176.5	0	110.4	L134 D138 E139	L134-K136 PolarHBondContact O-N 3.1Å; K136-D138 PolarHBondContact O-N 2.96Å; K136-E139 HydrophobicContact CB-CG 4.01Å; K136-E139 WeakPolarHBondContact CD-OE1 3.4Å; K136-E139 PolarHBondContact O-N 3.26Å
137	L	31.5	Very low	37.2	Very low	89 Å²	89	86 Å²	86	47%	0.466	47%	0.466	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.3	13.6	178.7	-92	133.8	0	0	0	117.1	W39	W39-L137 HydrophobicContact CB-CB 4.14Å; W39-L137 HydrophobicContact CB-CD1 3.63Å; W39-L137 HydrophobicContact CB-CD2 3.27Å; W39-L137 HydrophobicContact CB-CG 3.78Å; W39-L137 HydrophobicContact CD2-CB 3.48Å; W39-L137 VanDerWaalsContact CD2-CB 3.48Å; W39-L137 HydrophobicContact CD2-CD1 3.15Å; W39-L137 HydrophobicContact CD2-CD2 4.23Å; W39-L137 HydrophobicContact CD2-CG 3.69Å; W39-L137 HydrophobicContact CE3-CB 2.95Å; W39-L137 HydrophobicContact CE3-CD1 3.69Å; W39-L137 HydrophobicContact CE3-CD2 4.36Å; W39-L137 HydrophobicContact CE3-CG 3.74Å; W39-L137 HydrophobicContact CG-CB 4.07Å; W39-L137 HydrophobicContact CG-CD1 3.22Å; W39-L137 HydrophobicContact CG-CD2 3.91Å; W39-L137 HydrophobicContact CG-CG 3.83Å; W39-L137 HydrophobicContact CH2-CB 3.99Å; W39-L137 HydrophobicContact CH2-CD1 4.27Å; W39-L137 HydrophobicContact CZ2-CB 4.47Å; W39-L137 HydrophobicContact CZ2-CD1 3.91Å; W39-L137 HydrophobicContact CZ3-CB 3.25Å; W39-L137 HydrophobicContact CZ3-CD1 4.21Å; W39-L137 HydrophobicContact CZ3-CG 4.28Å
138	D	31.4	Very low	36.1	Very low	107 Å²	107	88.8 Å²	88.8	57%	0.572	50%	0.497	S	S	*	.	T	Hydrogen-bonded Turn	trans	-117.7	1.9	175.9	-90.9	3	0	0	0	112.7	K99 K136	K99-D138 HydrophobicContact CD-CB 4.18Å; K99-D138 IonicContact NZ-OD2 2.79Å; K99-D138 PolarHBondContact NZ-OD2 2.9Å; K136-D138 PolarHBondContact O-N 2.96Å
139	E	38.4	Very low	35.6	Very low	49 Å²	49	87.9 Å²	87.9	23%	0.229	50%	0.497	C	S	.	.	P	Polyproline II helix	trans	-94.6	128.3	-176.2	-65	-174.4	-176.3	0	0	112.1	K99 I101 L134 K136	K99-E139 HydrophobicContact CB-CG 4.28Å; K99-E139 CarbonylContact O-C 3.55Å; K99-E139 VanDerWaalsContact O-CA 3.25Å; K99-E139 WeakPolarHBondContact O-CA 3.43Å; I101-E139 HydrophobicContact CD1-CB 3.95Å; I101-E139 WeakPolarHBondContact CD1-OE2 3.41Å; I101-E139 HydrophobicContact CG1-CB 4.42Å; L134-E139 WeakPolarHBondContact CD2-OE2 3.19Å; K136-E139 HydrophobicContact CB-CG 4.01Å; K136-E139 WeakPolarHBondContact CD-OE1 3.4Å; K136-E139 PolarHBondContact O-N 3.26Å
140	M	32.2	Very low	34.8	Very low	98 Å²	98	84.2 Å²	84.2	48%	0.483	49%	0.487	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	122.2	178	-171.8	179.1	-170.9	0	0	109.6	L90 K99 H100 I101	L90-M140 HydrophobicContact CD2-CE 4.33Å; L90-M140 HydrophobicContact CD2-SD 4.17Å; K99-M140 PolarHBondContact O-N 3.05Å; H100-M140 CarbonylContact C-O 3.44Å; H100-M140 WeakPolarHBondContact CA-O 3.27Å; I101-M140 PolarHBondContact N-O 3.43Å
141	V	37.1	Very low	33.8	Very low	77 Å²	77	86.4 Å²	86.4	47%	0.467	50%	0.502	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	118.9	-178.4	-176.4	0	0	0	0	110.7	I101 I103 V143	I101-V141 HydrophobicContact CB-CG2 4.27Å; I101-V141 HydrophobicContact CD1-CG2 4.12Å; I101-V141 CarbonylContact O-C 3.47Å; I101-V141 WeakPolarHBondContact O-CA 3.12Å; I103-V141 HydrophobicContact CD1-CG1 3.43Å; I103-V141 VanDerWaalsContact CD1-CG1 3.43Å; I103-V141 HydrophobicContact CG1-CG1 3.87Å; V141-V143 HydrophobicContact CG1-CG2 4.32Å
142	T	35.2	Very low	32.9	Very low	34 Å²	34	94.3 Å²	94.3	21%	0.209	53%	0.528	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	115.3	173.7	-70.1	0	0	0	0	110	H100 I101 T102 I103 L144	H100-T142 PolarHBondContact CE1-OG1 3.24Å; H100-T142 VanDerWaalsContact CE1-OG1 3.31Å; H100-T142 PolarHBondContact NE2-OG1 3.33Å; I101-T142 PolarHBondContact O-N 3.21Å; T102-T142 CarbonylContact C-O 3.47Å; T102-T142 WeakPolarHBondContact CA-O 3.16Å; I103-T142 PolarHBondContact N-O 2.88Å; T142-L144 HydrophobicContact CG2-CD2 3.96Å; T142-L144 HydrophobicContact CG2-CG 4.13Å
143	V	37.7	Very low	32.3	Very low	95 Å²	95	97.4 Å²	97.4	58%	0.576	53%	0.529	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.9	122.2	176.2	-172.7	0	0	0	0	109.8	I103 V141	I103-V143 HydrophobicContact CB-CG1 4.43Å; I103-V143 HydrophobicContact CB-CG2 4.22Å; I103-V143 HydrophobicContact CD1-CG2 4.47Å; I103-V143 CarbonylContact O-C 3.57Å; I103-V143 VanDerWaalsContact O-CA 3.32Å; I103-V143 WeakPolarHBondContact O-CA 3.22Å; V141-V143 HydrophobicContact CG1-CG2 4.32Å
144	L	32.5	Very low	31.5	Very low	54 Å²	54	100.2 Å²	100.2	28%	0.283	53%	0.531	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	103.9	178	-60.1	177.3	0	0	0	110.7	T102 I103 L104 G105 L115 T142	T102-L144 HydrophobicContact CG2-CD1 3.42Å; T102-L144 VanDerWaalsContact CG2-CD1 3.42Å; T102-L144 HydrophobicContact CG2-CG 3.76Å; I103-L144 PolarHBondContact O-N 3.44Å; L104-L144 CarbonylContact C-O 3.55Å; L104-L144 VanDerWaalsContact CA-O 3.28Å; L104-L144 WeakPolarHBondContact CA-O 3.34Å; L104-L144 HydrophobicContact CD2-CB 3.82Å; L104-L144 HydrophobicContact CD2-CD1 4.03Å; L104-L144 HydrophobicContact CD2-CG 4.45Å; G105-L144 PolarHBondContact N-O 2.75Å; L115-L144 HydrophobicContact CD1-CD1 3.67Å; T142-L144 HydrophobicContact CG2-CD2 3.96Å; T142-L144 HydrophobicContact CG2-CG 4.13Å
145	G	29.6	Very low	30.6	Very low	41 Å²	41	107.1 Å²	107.1	42%	0.423	56%	0.562	S	S	.	*			trans	141.8	145.3	168.6	0	0	0	0	0	114.2
146	N	27.2	Very low	30.1	Very low	161 Å²	161	110.3 Å²	110.3	86%	0.861	57%	0.573	S	S	*	*			trans	-106.3	31.4	-177.8	-80.9	-6.8	0	0	0	113.1
147	G	26	Very low	29.3	Very low	29 Å²	29	113.4 Å²	113.4	30%	0.299	59%	0.586	S	S	.	*			trans	-106.7	119.8	-172.7	0	0	0	0	0	113.4	G105 V149	G105-G147 CarbonylContact O-C 3.36Å; G105-G147 WeakPolarHBondContact O-CA 3.5Å; G105-G147 PolarHBondContact O-N 3.31Å; G147-V149 PolarHBondContact O-N 2.59Å
148	A	24.9	Very low	29.2	Very low	103 Å²	103	117.7 Å²	117.7	85%	0.851	60%	0.604	S	S	*	*	P	Polyproline II helix	trans	-56	121.8	157.5	0	0	0	0	0	109	S150	A148-S150 PolarHBondContact O-N 2.96Å
149	V	26.8	Very low	28.9	Very low	78 Å²	78	119.1 Å²	119.1	47%	0.473	61%	0.611	S	S	.	*	P	Polyproline II helix	trans	-61	117.9	179.2	-177.9	0	0	0	0	108.9	V122 G147	V122-V149 HydrophobicContact CB-CG2 4.08Å; V122-V149 HydrophobicContact CG1-CG2 3.9Å; G147-V149 PolarHBondContact O-N 2.59Å
150	S	24.6	Very low	28.4	Very low	60 Å²	60	123.9 Å²	123.9	42%	0.42	63%	0.633	S	S	.	*	P	Polyproline II helix	trans	-85.1	120.1	-178.7	104.5	0	0	0	0	110.5	E107 A148 R152	E107-S150 WeakPolarHBondContact OE2-CB 3.33Å; E107-S150 PolarHBondContact OE2-OG 3.06Å; A148-S150 PolarHBondContact O-N 2.96Å; S150-R152 PolarHBondContact O-N 3.42Å; S150-R152 VanDerWaalsContact O-N 3.16Å
151	D	27.6	Very low	28.1	Very low	143 Å²	143	125.5 Å²	125.5	77%	0.765	64%	0.644	S	S	*	*			trans	-81.9	94.9	-177.9	-158.6	-0.7	0	0	0	110.7	R153	D151-R153 VanDerWaalsContact C-N 3.29Å; D151-R153 PolarHBondContact O-N 3.37Å
152	R	24.3	Very low	27.6	Very low	213 Å²	213	128.3 Å²	128.3	80%	0.804	66%	0.661	S	S	*	*			trans	-74.6	73.7	173.4	-76.6	-173.9	175.3	-170	0.2	111.3	S150	S150-R152 PolarHBondContact O-N 3.42Å; S150-R152 VanDerWaalsContact O-N 3.16Å
153	R	26	Very low	27	Very low	218 Å²	218	132 Å²	132	82%	0.823	69%	0.686	S	S	*	*			trans	-134.3	71.7	160.3	-67.1	-168.1	-160	-173.4	6.2	111.8	D151	D151-R153 VanDerWaalsContact C-N 3.29Å; D151-R153 PolarHBondContact O-N 3.37Å
154	K	25.9	Very low	26.5	Very low	140 Å²	140	135.9 Å²	135.9	61%	0.609	70%	0.702	S	S	*	*			trans	-138.4	79	163.7	-86.2	-170	175.9	170.3	0	111
155	H	26.4	Very low	25.9	Very low	189 Å²	189	141.7 Å²	141.7	88%	0.875	73%	0.728	S	S	*	*			trans	-157.4	90.5	154.8	-79.4	-61.8	0	0	0	109.7
156	Q	26.2	Very low	25.6	Very low	205 Å²	205	147.1 Å²	147.1	96%	0.958	74%	0.742	S	S	*	*			trans	-177.5	140.5	134.6	-104.8	169.6	-6.8	0	0	111.4
157	K	24.9	Very low	25.5	Very low	199 Å²	199	147.4 Å²	147.4	87%	0.865	74%	0.736	S	S	*	*			trans	-82.6	154.1	-170.4	-70.3	167.5	166.7	177.3	0	112.5
158	Q	28.4	Very low	25.2	Very low	179 Å²	179	154.8 Å²	154.8	84%	0.836	76%	0.762	S	S	*	*				165.2	117.7	128.5	-91.2	171.6	-13	0	0	108.6
159	N	25.1	Very low	25.1	Very low	136 Å²	136	155.3 Å²	155.3	73%	0.727	76%	0.759	S	S	*	*				52.4	124.1	98.5	-79.6	27.6	0	0	0	111.7
160	E	27.2	Very low	24.7	Very low	149 Å²	149	159.4 Å²	159.4	70%	0.696	78%	0.778	S	S	*	*			cis	-175	152.6	35	-108.2	158.8	-148.7	0	0	110.2
161	N	27.5	Very low	24.6	Very low	133 Å²	133	164 Å²	164	71%	0.711	80%	0.796	S	S	*	*			trans	67.8	114.5	137.3	-61.6	-14.4	0	0	0	124.5
162	T	26.2	Very low	24.4	Very low	135 Å²	135	164.5 Å²	164.5	83%	0.828	80%	0.799	S	S	*	*				105.4	135.9	129.7	-8.1	0	0	0	0	120.7
163	P	23	Very low	24.3	Very low	113 Å²	113	159 Å²	159	73%	0.734	79%	0.791	S	S	*	*			trans	-109.3	162	-170	40.1	-27.6	0	0	0	114.6
164	I	25.6	Very low	24	Very low	176 Å²	176	158.3 Å²	158.3	90%	0.903	79%	0.794	S	S	*	*			trans	-142	135	169.7	-59.7	-179.5	0	0	0	111.4
165	Q	21.1	Very low	23.9	Very low	176 Å²	176	160.8 Å²	160.8	82%	0.822	81%	0.807	S	S	*	*			trans	-80.4	-178.3	174.7	-78.1	179	-20.7	0	0	113.2
166	E	23.5	Very low	23.8	Very low	154 Å²	154	156.6 Å²	156.6	72%	0.72	80%	0.799	S	S	*	*			trans	93	143.4	167.9	-53.5	-160.6	143.9	0	0	115.5
167	K	23.7	Very low	23.5	Very low	168 Å²	168	151.7 Å²	151.7	73%	0.73	79%	0.788	S	S	*	*			cis	-165.8	162.4	-5.9	-116.8	167.4	-178.9	147.5	0	106.9
168	E	20.3	Very low	23.3	Very low	184 Å²	184	149.2 Å²	149.2	86%	0.86	79%	0.789	S	S	*	*			trans	-54.7	150	175.2	-60	164	143.4	0	0	114.4
169	S	22.1	Very low	22.9	Very low	113 Å²	113	149.3 Å²	149.3	79%	0.79	79%	0.79	S	S	*	*			trans	-162.4	122.4	139.6	58.3	0	0	0	0	112
170	L	20	Very low	22.7	Very low	164 Å²	164	151.8 Å²	151.8	86%	0.859	79%	0.794	S	S	*	*			trans	-57.8	139	166.3	-71.6	82.2	0	0	0	111.7
171	I	22.7	Very low	22.5	Very low	156 Å²	156	151.9 Å²	151.9	80%	0.8	80%	0.798	S	S	*	*			trans	-144.5	119.6	145.4	-56.1	-178.1	0	0	0	108.5	P173	I171-P173 HydrophobicContact CG2-CG 4.28Å
172	N	23	Very low	22.2	Very low	155 Å²	155	152.3 Å²	152.3	83%	0.829	80%	0.799	S	S	*	*			trans	-113.5	130.1	164.5	-165.6	3.8	0	0	0	106.9
173	P	21.3	Very low	21.9	Very low	97 Å²	97	154 Å²	154	63%	0.63	80%	0.803	S	S	*	*			trans	-142.3	120	150	29.1	-8.2	0	0	0	113.2	I171	I171-P173 HydrophobicContact CG2-CG 4.28Å
174	K	20.8	Very low	21.9	Very low	204 Å²	204	152.9 Å²	152.9	89%	0.887	80%	0.798	S	S	*	*			trans	16.9	111.7	138.5	-64.5	177.8	176.6	178.5	0	117.2
175	Q	23.7	Very low	21.7	Very low	191 Å²	191	157 Å²	157	89%	0.893	80%	0.802	S	S	*	*			trans	-140.3	113.9	147.7	-78.2	-171	-24.4	0	0	106.8
176	S	22.6	Very low	21.7	Very low	101 Å²	101	151.7 Å²	151.7	71%	0.706	79%	0.794	S	S	*	*				109	84.5	56.9	169.5	0	0	0	0	108.7
177	S	20.5	Very low	21.6	Very low	102 Å²	102	153.6 Å²	153.6	71%	0.713	80%	0.8	S	S	*	*			trans	17.1	111.6	137.1	51.2	0	0	0	0	119
178	V	21.5	Very low	21.5	Very low	148 Å²	148	151.3 Å²	151.3	90%	0.897	80%	0.802	S	S	*	*				-139.8	89.3	128.8	-178.5	0	0	0	0	107.9
179	Q	20.3	Very low	21.5	Very low	181 Å²	181	151.6 Å²	151.6	85%	0.846	80%	0.801	S	S	*	*			trans	-103	126.2	160.1	-167.2	155.4	12.4	0	0	105.6
180	K	20.8	Very low	21.6	Very low	188 Å²	188	151.9 Å²	151.9	82%	0.817	80%	0.798	S	S	*	*			trans	138.3	146.8	158	-79.4	172.4	178.2	-178.9	0	111.5
181	I	21.5	Very low	21.6	Very low	151 Å²	151	153.9 Å²	153.9	77%	0.774	80%	0.8	S	S	*	*			trans	99.5	72	168.4	-48.8	162.1	0	0	0	113.4
182	L	21.7	Very low	21.7	Very low	142 Å²	142	154.3 Å²	154.3	74%	0.743	80%	0.803	S	S	*	*				169.4	77.2	104.7	-87.6	150.9	0	0	0	111.8	S184	L182-S184 PolarHBondContact O-N 3.01Å
183	D	20.4	Very low	21.5	Very low	170 Å²	170	151.2 Å²	151.2	91%	0.909	79%	0.791	S	S	*	*			trans	-66.2	114.9	139.8	-87.9	-42.1	0	0	0	107.5
184	S	22.4	Very low	21.6	Very low	90 Å²	90	152.8 Å²	152.8	63%	0.629	80%	0.799	S	S	*	*			trans	-176.7	105.4	146.7	29.4	0	0	0	0	110.4	L182 G186	L182-S184 PolarHBondContact O-N 3.01Å; S184-G186 PolarHBondContact O-N 2.98Å
185	R	21.6	Very low	21.6	Very low	263 Å²	263	150.6 Å²	150.6	99%	0.992	80%	0.797	S	S	*	*			trans	-6	97	145.7	-62.4	174.2	179.8	-172.9	-1.3	113.9
186	G	21.4	Very low	21.6	Very low	63 Å²	63	150.2 Å²	150.2	65%	0.649	79%	0.792	S	S	*	*			trans	-166.6	107.2	172.1	0	0	0	0	0	110.4	S184 P188	S184-G186 PolarHBondContact O-N 2.98Å; G186-P188 VanDerWaalsContact O-CD 3.28Å; G186-P188 WeakPolarHBondContact O-CD 3.33Å
187	K	20.9	Very low	21.7	Very low	195 Å²	195	153.7 Å²	153.7	85%	0.848	80%	0.801	S	S	*	*			trans	-56.9	120	174.6	-70.7	175.1	176.4	176.2	0	109.8	K189	K187-K189 VanDerWaalsContact C-N 3.33Å; K187-K189 PolarHBondContact O-N 2.9Å; K187-K189 VanDerWaalsContact O-N 3.09Å
188	P	22.4	Very low	21.8	Very low	119 Å²	119	152.8 Å²	152.8	77%	0.773	80%	0.795	S	S	*	*			trans	-80.3	92.3	158.7	7.9	10.8	0	0	0	107	G186 T190	G186-P188 VanDerWaalsContact O-CD 3.28Å; G186-P188 WeakPolarHBondContact O-CD 3.33Å; P188-T190 VanDerWaalsContact C-N 3.32Å; P188-T190 PolarHBondContact O-N 3.34Å; P188-T190 VanDerWaalsContact O-N 3.1Å
189	K	20.8	Very low	21.9	Very low	190 Å²	190	155.1 Å²	155.1	83%	0.826	79%	0.793	S	S	*	*			trans	-66.3	92.7	158.1	-78.8	179	173.1	178.4	0	107.5	K187	K187-K189 VanDerWaalsContact C-N 3.33Å; K187-K189 PolarHBondContact O-N 2.9Å; K187-K189 VanDerWaalsContact O-N 3.09Å
190	T	22.4	Very low	22.1	Very low	119 Å²	119	155.1 Å²	155.1	73%	0.73	79%	0.79	S	S	*	*			trans	-157.7	107.3	161.3	9	0	0	0	0	110.4	P188 L192	P188-T190 VanDerWaalsContact C-N 3.32Å; P188-T190 PolarHBondContact O-N 3.34Å; P188-T190 VanDerWaalsContact O-N 3.1Å; T190-L192 PolarHBondContact O-N 3.29Å
191	K	21.9	Very low	22.3	Very low	207 Å²	207	155.7 Å²	155.7	90%	0.9	79%	0.788	S	S	*	*			trans	-54.1	115	163.4	-72.4	176.6	174.1	-179.4	0	107.7	P193	K191-P193 WeakPolarHBondContact O-CD 3.38Å
192	L	22.9	Very low	22.4	Very low	165 Å²	165	152 Å²	152	86%	0.864	78%	0.776	S	S	*	*			trans	-66.7	122.4	166.2	-90.1	158.1	0	0	0	107.6	T190 T194	T190-L192 PolarHBondContact O-N 3.29Å; L192-T194 PolarHBondContact O-N 3.17Å; L192-T194 VanDerWaalsContact O-N 3.16Å
193	P	20.7	Very low	22.6	Very low	90 Å²	90	151.5 Å²	151.5	58%	0.584	77%	0.773	S	S	*	*			trans	-73.3	111.8	-174.5	28	-29.7	0	0	0	109.3	K191 N195	K191-P193 WeakPolarHBondContact O-CD 3.38Å; P193-N195 PolarHBondContact O-N 3.2Å
194	T	22.3	Very low	22.7	Very low	130 Å²	130	149.2 Å²	149.2	80%	0.798	76%	0.761	S	S	*	*	S	Bend	trans	-46.6	127.2	147.6	39.5	0	0	0	0	108.3	L192	L192-T194 PolarHBondContact O-N 3.17Å; L192-T194 VanDerWaalsContact O-N 3.16Å
195	N	20.9	Very low	22.8	Very low	157 Å²	157	155.5 Å²	155.5	84%	0.84	77%	0.771	S	S	*	*			trans	77.2	70.1	180	-58.1	-15.6	0	0	0	117.2	P193	P193-N195 PolarHBondContact O-N 3.2Å
196	K	24.2	Very low	23	Very low	184 Å²	184	146 Å²	146	80%	0.8	74%	0.739	S	S	*	*			trans	-146	103.5	142.9	-74.1	-165.4	179.3	176.2	0	109.7	S198	K196-S198 PolarHBondContact O-N 3.49Å
197	I	23.7	Very low	23.2	Very low	174 Å²	174	151.3 Å²	151.3	89%	0.892	74%	0.744	S	S	*	*			trans	-60.3	99.5	165.7	-63	166.7	0	0	0	106.4	K199	I197-K199 PolarHBondContact O-N 3.15Å
198	S	23.1	Very low	23.3	Very low	82 Å²	82	146.9 Å²	146.9	57%	0.573	73%	0.729	S	S	*	*			trans	-77	116.5	177.2	63.8	0	0	0	0	109.3	K196	K196-S198 PolarHBondContact O-N 3.49Å
199	K	23.6	Very low	23.5	Very low	198 Å²	198	142.3 Å²	142.3	86%	0.861	70%	0.702	S	S	*	*	S	Bend	trans	-36.1	135.4	168.3	-65.4	171.7	174.2	179.8	0	112.8	I197	I197-K199 PolarHBondContact O-N 3.15Å
200	K	23.9	Very low	23.8	Very low	180 Å²	180	135.4 Å²	135.4	78%	0.783	68%	0.676	S	S	*	*			trans	51.5	90.7	159.5	-69.5	-176.2	172.5	-173.1	0	115.8
201	Y	25	Very low	24.1	Very low	201 Å²	201	132.3 Å²	132.3	79%	0.788	66%	0.657	S	S	*	*			trans	-86.8	96.2	145.5	-84.1	-86	0	0	0	107.1
202	S	23.9	Very low	24.4	Very low	74 Å²	74	125 Å²	125	52%	0.517	63%	0.627	S	S	.	*			trans	-75.4	128.8	158.5	64.5	0	0	0	0	107.1	D204	S202-D204 WeakPolarHBondContact CB-OD2 3.4Å; S202-D204 PolarHBondContact O-N 3.23Å; S202-D204 PolarHBondContact OG-OD2 3.28Å
203	L	25.7	Very low	24.7	Very low	131 Å²	131	120.9 Å²	120.9	69%	0.686	61%	0.608	S	S	*	*			trans	-74.6	46.2	168.7	-84.4	149.3	0	0	0	109.4	R205 M206	L203-R205 PolarHBondContact O-N 2.87Å; L203-M206 HydrophobicContact CD2-CE 3.27Å; L203-M206 HydrophobicContact CD2-SD 4.16Å
204	D	23.8	Very low	25.1	Very low	122 Å²	122	122.4 Å²	122.4	65%	0.652	61%	0.608	S	S	*	*			trans	-78.1	116	175	-75.3	-39.7	0	0	0	108.5	S202	S202-D204 WeakPolarHBondContact CB-OD2 3.4Å; S202-D204 PolarHBondContact O-N 3.23Å; S202-D204 PolarHBondContact OG-OD2 3.28Å
205	R	23.8	Very low	25.5	Very low	221 Å²	221	117.9 Å²	117.9	83%	0.834	58%	0.578	S	S	*	*			trans	72.9	66.5	167	-53.7	176.5	174.3	-174.3	-1.8	115.9	L203 K207	L203-R205 PolarHBondContact O-N 2.87Å; R205-K207 PolarHBondContact O-N 3.5Å
206	M	25.7	Very low	25.9	Very low	64 Å²	64	111.2 Å²	111.2	32%	0.315	54%	0.544	S	S	.	.			trans	-90.9	78.3	152.5	-73.3	-168.7	-59.2	0	0	109.7	L203 N208 A209 L234	L203-M206 HydrophobicContact CD2-CE 3.27Å; L203-M206 HydrophobicContact CD2-SD 4.16Å; M206-N208 PolarHBondContact O-N 3.19Å; M206-A209 HydrophobicContact CB-CB 3.8Å; M206-A209 HydrophobicContact CE-CB 4.42Å; M206-A209 HydrophobicContact CG-CB 3.97Å; M206-A209 HydrophobicContact SD-CB 3.49Å; M206-A209 WeakPolarHBondContact SD-CB 3.21Å; M206-L234 HydrophobicContact CE-CD1 4.27Å; M206-L234 HydrophobicContact SD-CD1 3.43Å; M206-L234 WeakPolarHBondContact SD-CD1 3.22Å
207	K	25.1	Very low	26.1	Very low	175 Å²	175	105.6 Å²	105.6	76%	0.761	53%	0.528	S	S	*	.	S	Bend	trans	-71.2	-6.5	176.5	-79.5	-170.2	173.4	-173.3	0	113.8	R205	R205-K207 PolarHBondContact O-N 3.5Å
208	N	24.8	Very low	26.4	Very low	101 Å²	101	103.7 Å²	103.7	54%	0.54	53%	0.527	S	S	.	.	S	Bend	trans	-163.3	95.5	174.9	-73.8	-46.3	0	0	0	107.1	M206 C229 C276	M206-N208 PolarHBondContact O-N 3.19Å; N208-C229 WeakPolarHBondContact O-CB 3.38Å; N208-C229 PolarHBondContact O-SG 3.23Å; N208-C276 WeakPolarHBondContact OD1-CB 3.17Å; N208-C276 PolarHBondContact OD1-SG 3.45Å
209	A	25.9	Very low	26.8	Very low	24 Å²	24	103 Å²	103	20%	0.198	53%	0.533	C	S	.	.			trans	-139.5	121.6	172.1	0	0	0	0	0	109.3	M206 V211	M206-A209 HydrophobicContact CB-CB 3.8Å; M206-A209 HydrophobicContact CE-CB 4.42Å; M206-A209 HydrophobicContact CG-CB 3.97Å; M206-A209 HydrophobicContact SD-CB 3.49Å; M206-A209 WeakPolarHBondContact SD-CB 3.21Å; A209-V211 PolarHBondContact O-N 2.8Å
210	T	27.7	Very low	27.4	Very low	45 Å²	45	96.4 Å²	96.4	28%	0.276	51%	0.505	S	S	.	.			trans	-82.2	113.1	166.2	-45.6	0	0	0	0	106.4	H228	T210-H228 VanDerWaalsContact CB-CB 3.43Å; T210-H228 HydrophobicContact CG2-CB 4.35Å; T210-H228 PolarHBondContact O-N 3.07Å
211	V	28.2	Very low	28.1	Very low	54 Å²	54	91.4 Å²	91.4	33%	0.327	49%	0.487	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	109.7	174	178.4	0	0	0	0	108.7	A209 V213 I225 Y226	A209-V211 PolarHBondContact O-N 2.8Å; V211-V213 HydrophobicContact CG1-CG2 4.19Å; V211-I225 HydrophobicContact CG1-CG2 3.86Å; V211-I225 HydrophobicContact CG2-CG2 4.47Å; V211-Y226 WeakPolarHBondContact CA-O 3.22Å
212	I	27.5	Very low	28.6	Very low	52 Å²	52	85.6 Å²	85.6	27%	0.267	46%	0.464	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	111.5	170.5	-52.3	178.5	0	0	0	107.5	Q214 S224 Y226	I212-Q214 HydrophobicContact CG2-CB 4.43Å; I212-Q214 PolarHBondContact O-N 3.37Å; I212-S224 VanDerWaalsContact O-O 3.05Å; I212-Y226 HydrophobicContact CB-CD1 4.4Å; I212-Y226 HydrophobicContact CD1-CD1 3.67Å; I212-Y226 HydrophobicContact CD1-CE1 4.13Å; I212-Y226 HydrophobicContact CG1-CD1 4.06Å; I212-Y226 PolarHBondContact N-O 3.44Å
213	V	30.3	Very low	29.4	Very low	80 Å²	80	83.7 Å²	83.7	49%	0.485	45%	0.447	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	94.8	167.6	-178.9	0	0	0	0	107.4	V211 L215 L223	V211-V213 HydrophobicContact CG1-CG2 4.19Å; V213-L215 PolarHBondContact O-N 3.36Å; V213-L223 HydrophobicContact CG1-CD1 3.57Å; V213-L223 HydrophobicContact CG1-CG 3.93Å
214	Q	28.6	Very low	30	Very low	121 Å²	121	77.9 Å²	77.9	57%	0.565	42%	0.418	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.9	105	175.9	-160.3	171.4	3.7	0	0	108.5	I212 S216	I212-Q214 HydrophobicContact CG2-CB 4.43Å; I212-Q214 PolarHBondContact O-N 3.37Å; Q214-S216 PolarHBondContact O-N 3.4Å
215	L	31.4	Very low	30.8	Very low	35 Å²	35	74.3 Å²	74.3	18%	0.183	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	96.3	156.4	-72.5	174.1	0	0	0	106	V213 I261 V266	V213-L215 PolarHBondContact O-N 3.36Å; L215-I261 HydrophobicContact CD1-CD1 4.47Å; L215-I261 HydrophobicContact CD2-CD1 3.89Å; L215-V266 HydrophobicContact CD1-CG1 3.81Å
216	S	27.7	Very low	31.6	Very low	17 Å²	17	67 Å²	67	12%	0.119	37%	0.371	C	S	.	.			trans	-71	145.3	176.9	61.8	0	0	0	0	107	Q214 Q220 W222	Q214-S216 PolarHBondContact O-N 3.4Å; S216-Q220 VanDerWaalsContact OG-CB 3.28Å; S216-Q220 WeakPolarHBondContact OG-CB 3.28Å; S216-Q220 VanDerWaalsContact OG-CD 3.25Å; S216-Q220 PolarHBondContact OG-OE1 2.7Å; S216-W222 VanDerWaalsContact CB-CH2 3.46Å; S216-W222 WeakPolarHBondContact OG-CH2 3.4Å; S216-W222 VanDerWaalsContact OG-CZ2 3.3Å; S216-W222 WeakPolarHBondContact OG-CZ2 3.39Å; S216-W222 WeakPolarHBondContact OG-CZ3 3.44Å
217	S	29.3	Very low	32.3	Very low	66 Å²	66	64 Å²	64	46%	0.462	36%	0.357	S	S	.	.	S	Bend	trans	-8.2	149.7	-173.7	58	0	0	0	0	120.8	G219 Q220	S217-G219 PolarHBondContact O-N 3.35Å; S217-Q220 PolarHBondContact O-N 3.46Å; S217-Q220 PolarHBondContact OG-OE1 3.33Å
218	P	29.9	Very low	32.9	Very low	134 Å²	134	60.7 Å²	60.7	87%	0.87	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.9	103.5	175.3	23.4	-32.7	0	0	0	111.4
219	G	32.1	Very low	33.4	Very low	68 Å²	68	59.6 Å²	59.6	70%	0.701	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	130.5	-16.4	-172.9	0	0	0	0	0	114.3	S217	S217-G219 PolarHBondContact O-N 3.35Å
220	Q	35.5	Very low	34.1	Very low	59 Å²	59	65.2 Å²	65.2	28%	0.276	36%	0.363	S	S	.	.			trans	-81	129.2	178.2	-82.7	168.3	-39.7	0	0	112.5	S216 S217 W222	S216-Q220 VanDerWaalsContact OG-CB 3.28Å; S216-Q220 WeakPolarHBondContact OG-CB 3.28Å; S216-Q220 VanDerWaalsContact OG-CD 3.25Å; S216-Q220 PolarHBondContact OG-OE1 2.7Å; S217-Q220 PolarHBondContact O-N 3.46Å; S217-Q220 PolarHBondContact OG-OE1 3.33Å; Q220-W222 VanDerWaalsContact C-N 3.32Å; Q220-W222 HydrophobicContact CG-CZ2 4.25Å; Q220-W222 VanDerWaalsContact NE2-CZ2 3.26Å
221	N	37.9	Very low	34.7	Very low	76 Å²	76	70.8 Å²	70.8	41%	0.406	39%	0.386	S	S	.	.			trans	-99.3	30.7	-176.2	-67.8	-33.9	0	0	0	111.3	N238 I239 S240	N221-N238 CarbonylContact O-C 3.25Å; N221-N238 WeakPolarHBondContact O-CA 3.47Å; N221-N238 PolarHBondContact O-OD1 3.24Å; N221-I239 WeakPolarHBondContact O-CG1 3.45Å; N221-I239 PolarHBondContact O-N 3.34Å; N221-S240 WeakPolarHBondContact CB-OG 3.32Å; N221-S240 WeakPolarHBondContact ND2-CB 3.25Å; N221-S240 PolarHBondContact O-N 2.93Å
222	W	36.5	Very low	35.1	Very low	79 Å²	79	72.4 Å²	72.4	30%	0.299	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146	151.6	178.4	51.3	-92.7	0	0	0	112.1	S216 Q220 S224 I237	S216-W222 VanDerWaalsContact CB-CH2 3.46Å; S216-W222 WeakPolarHBondContact OG-CH2 3.4Å; S216-W222 VanDerWaalsContact OG-CZ2 3.3Å; S216-W222 WeakPolarHBondContact OG-CZ2 3.39Å; S216-W222 WeakPolarHBondContact OG-CZ3 3.44Å; Q220-W222 VanDerWaalsContact C-N 3.32Å; Q220-W222 HydrophobicContact CG-CZ2 4.25Å; Q220-W222 VanDerWaalsContact NE2-CZ2 3.26Å; W222-S224 WeakPolarHBondContact CZ3-OG 3.45Å; W222-I237 CarbonylContact C-O 3.57Å; W222-I237 WeakPolarHBondContact CA-O 3.46Å
223	L	40.7	Very low	35.7	Very low	33 Å²	33	73 Å²	73	17%	0.173	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	122	176.1	175.1	143.8	0	0	0	108	V213 I225 K236 I237 I239	V213-L223 HydrophobicContact CG1-CD1 3.57Å; V213-L223 HydrophobicContact CG1-CG 3.93Å; L223-I225 HydrophobicContact CD2-CG1 4.2Å; L223-K236 CarbonylContact O-C 3.45Å; L223-K236 WeakPolarHBondContact O-CA 3.48Å; L223-I237 HydrophobicContact CB-CB 4.21Å; L223-I237 HydrophobicContact CD2-CB 4.24Å; L223-I237 HydrophobicContact CD2-CD1 3.65Å; L223-I237 HydrophobicContact CD2-CG1 4.36Å; L223-I237 PolarHBondContact N-O 3.34Å; L223-I237 PolarHBondContact O-N 3.47Å; L223-I239 HydrophobicContact CB-CG2 4.27Å
224	S	37.7	Very low	36	Very low	10 Å²	10	71.9 Å²	71.9	7%	0.07	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	137	176.1	-74.4	0	0	0	0	111.1	I212 W222 A235	I212-S224 VanDerWaalsContact O-O 3.05Å; W222-S224 WeakPolarHBondContact CZ3-OG 3.45Å; S224-A235 CarbonylContact C-O 3.45Å; S224-A235 VanDerWaalsContact CA-O 3.29Å; S224-A235 WeakPolarHBondContact CA-O 3.45Å
225	I	41	Very low	36.3	Very low	47 Å²	47	67.8 Å²	67.8	24%	0.241	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	110.5	165.1	-57.9	-176.9	0	0	0	106.2	V211 L223 T233 L234 A235 I237	V211-I225 HydrophobicContact CG1-CG2 3.86Å; V211-I225 HydrophobicContact CG2-CG2 4.47Å; L223-I225 HydrophobicContact CD2-CG1 4.2Å; I225-T233 CarbonylContact O-C 3.38Å; I225-L234 HydrophobicContact CB-CB 4.46Å; I225-L234 HydrophobicContact CG2-CB 4.15Å; I225-L234 HydrophobicContact CG2-CD1 4.2Å; I225-L234 PolarHBondContact O-N 3.43Å; I225-A235 HydrophobicContact CB-CB 4.06Å; I225-A235 HydrophobicContact CD1-CB 4Å; I225-A235 HydrophobicContact CG1-CB 4.13Å; I225-A235 PolarHBondContact N-O 2.9Å; I225-A235 PolarHBondContact O-N 2.97Å; I225-I237 HydrophobicContact CD1-CD1 3.96Å; I225-I237 HydrophobicContact CG1-CD1 4.35Å
226	Y	39.6	Very low	36.6	Very low	67 Å²	67	73.1 Å²	73.1	26%	0.263	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	135.9	178.6	-175.4	-104.2	0	0	0	110.7	V211 I212 H228 E231 I232	V211-Y226 WeakPolarHBondContact CA-O 3.22Å; I212-Y226 HydrophobicContact CB-CD1 4.4Å; I212-Y226 HydrophobicContact CD1-CD1 3.67Å; I212-Y226 HydrophobicContact CD1-CE1 4.13Å; I212-Y226 HydrophobicContact CG1-CD1 4.06Å; I212-Y226 PolarHBondContact N-O 3.44Å; Y226-H228 HydrophobicContact CD1-CB 4.3Å; Y226-H228 HydrophobicContact CE1-CB 4.15Å; Y226-E231 VanDerWaalsContact OH-CA 3.25Å; Y226-E231 WeakPolarHBondContact OH-CA 3.34Å; Y226-I232 WeakPolarHBondContact CD2-O 3.49Å
227	D	41.3	Very low	37	Very low	1 Å²	1	76.1 Å²	76.1	1%	0.005	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	103.7	168.8	-178.9	-8.4	0	0	0	108.8	C229 K230 E231 I232 L234	D227-C229 PolarHBondContact O-N 3.11Å; D227-C229 WeakPolarHBondContact OD1-CA 3.49Å; D227-C229 WeakPolarHBondContact OD1-CB 3.43Å; D227-C229 PolarHBondContact OD1-N 3.17Å; D227-K230 HydrophobicContact CB-CB 4.44Å; D227-K230 PolarHBondContact O-N 3.46Å; D227-K230 PolarHBondContact OD1-N 3.04Å; D227-K230 VanDerWaalsContact OD2-CD 3.23Å; D227-K230 WeakPolarHBondContact OD2-CD 3.37Å; D227-K230 WeakPolarHBondContact OD2-CG 3.19Å; D227-K230 IonicContact OD2-NZ 3.95Å; D227-E231 WeakPolarHBondContact O-CA 3.41Å; D227-E231 PolarHBondContact O-N 3.33Å; D227-I232 HydrophobicContact CB-CG2 4.01Å; D227-I232 PolarHBondContact N-O 3.46Å; D227-I232 PolarHBondContact O-N 2.79Å; D227-L234 HydrophobicContact CB-CD1 3.75Å; D227-L234 HydrophobicContact CB-CD2 4.02Å; D227-L234 HydrophobicContact CB-CG 3.7Å
228	H	37.7	Very low	37.2	Very low	105 Å²	105	77.3 Å²	77.3	49%	0.486	41%	0.413	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-25.1	178.2	-169.7	-51.3	0	0	0	113.4	T210 Y226 K230	T210-H228 VanDerWaalsContact CB-CB 3.43Å; T210-H228 HydrophobicContact CG2-CB 4.35Å; T210-H228 PolarHBondContact O-N 3.07Å; Y226-H228 HydrophobicContact CD1-CB 4.3Å; Y226-H228 HydrophobicContact CE1-CB 4.15Å; H228-K230 VanDerWaalsContact C-N 3.3Å
229	C	35.8	Very low	37.6	Very low	79 Å²	79	74.5 Å²	74.5	53%	0.534	39%	0.39	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.6	-21.6	-179.2	-68.1	0	0	0	0	112.1	N208 D227	N208-C229 WeakPolarHBondContact O-CB 3.38Å; N208-C229 PolarHBondContact O-SG 3.23Å; D227-C229 PolarHBondContact O-N 3.11Å; D227-C229 WeakPolarHBondContact OD1-CA 3.49Å; D227-C229 WeakPolarHBondContact OD1-CB 3.43Å; D227-C229 PolarHBondContact OD1-N 3.17Å
230	K	40.4	Very low	37.7	Very low	142 Å²	142	72.4 Å²	72.4	62%	0.617	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.8	2.1	178.9	-65.5	-177.7	-167.3	163.2	0	113.6	D227 H228 I232	D227-K230 HydrophobicContact CB-CB 4.44Å; D227-K230 PolarHBondContact O-N 3.46Å; D227-K230 PolarHBondContact OD1-N 3.04Å; D227-K230 VanDerWaalsContact OD2-CD 3.23Å; D227-K230 WeakPolarHBondContact OD2-CD 3.37Å; D227-K230 WeakPolarHBondContact OD2-CG 3.19Å; D227-K230 IonicContact OD2-NZ 3.95Å; H228-K230 VanDerWaalsContact C-N 3.3Å; K230-I232 HydrophobicContact CB-CB 4.44Å; K230-I232 HydrophobicContact CB-CG2 3.66Å; K230-I232 HydrophobicContact CD-CG2 4.5Å; K230-I232 PolarHBondContact O-N 2.77Å; K230-I232 VanDerWaalsContact O-N 3.16Å
231	E	39.5	Very low	37.5	Very low	161 Å²	161	72 Å²	72	75%	0.752	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.7	36.6	-173.3	-61.1	-175.2	165.1	0	0	113.8	Y226 D227	Y226-E231 VanDerWaalsContact OH-CA 3.25Å; Y226-E231 WeakPolarHBondContact OH-CA 3.34Å; D227-E231 WeakPolarHBondContact O-CA 3.41Å; D227-E231 PolarHBondContact O-N 3.33Å
232	I	36.6	Very low	37	Very low	88 Å²	88	72.5 Å²	72.5	45%	0.451	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	143.3	-173.7	-166	171	0	0	0	111.8	Y226 D227 K230 L234	Y226-I232 WeakPolarHBondContact CD2-O 3.49Å; D227-I232 HydrophobicContact CB-CG2 4.01Å; D227-I232 PolarHBondContact N-O 3.46Å; D227-I232 PolarHBondContact O-N 2.79Å; K230-I232 HydrophobicContact CB-CB 4.44Å; K230-I232 HydrophobicContact CB-CG2 3.66Å; K230-I232 HydrophobicContact CD-CG2 4.5Å; K230-I232 PolarHBondContact O-N 2.77Å; K230-I232 VanDerWaalsContact O-N 3.16Å; I232-L234 HydrophobicContact CG2-CD2 3.96Å; I232-L234 PolarHBondContact O-N 3.27Å
233	T	40.3	Very low	36.5	Very low	64 Å²	64	75.6 Å²	75.6	39%	0.393	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	112.8	165.7	-56.1	0	0	0	0	109	I225 A235 K236	I225-T233 CarbonylContact O-C 3.38Å; T233-A235 WeakPolarHBondContact CG2-O 3.39Å; T233-K236 HydrophobicContact CG2-CG 3.97Å
234	L	36	Very low	35.8	Very low	57 Å²	57	81.8 Å²	81.8	30%	0.298	44%	0.438	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74	-37.8	178.4	-64.8	177.6	0	0	0	112.6	M206 I225 D227 I232	M206-L234 HydrophobicContact CE-CD1 4.27Å; M206-L234 HydrophobicContact SD-CD1 3.43Å; M206-L234 WeakPolarHBondContact SD-CD1 3.22Å; I225-L234 HydrophobicContact CB-CB 4.46Å; I225-L234 HydrophobicContact CG2-CB 4.15Å; I225-L234 HydrophobicContact CG2-CD1 4.2Å; I225-L234 PolarHBondContact O-N 3.43Å; D227-L234 HydrophobicContact CB-CD1 3.75Å; D227-L234 HydrophobicContact CB-CD2 4.02Å; D227-L234 HydrophobicContact CB-CG 3.7Å; I232-L234 HydrophobicContact CG2-CD2 3.96Å; I232-L234 PolarHBondContact O-N 3.27Å
235	A	36.2	Very low	35.1	Very low	36 Å²	36	86.7 Å²	86.7	30%	0.298	47%	0.472	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.4	150.5	-179	0	0	0	0	0	111.7	S224 I225 T233	S224-A235 CarbonylContact C-O 3.45Å; S224-A235 VanDerWaalsContact CA-O 3.29Å; S224-A235 WeakPolarHBondContact CA-O 3.45Å; I225-A235 HydrophobicContact CB-CB 4.06Å; I225-A235 HydrophobicContact CD1-CB 4Å; I225-A235 HydrophobicContact CG1-CB 4.13Å; I225-A235 PolarHBondContact N-O 2.9Å; I225-A235 PolarHBondContact O-N 2.97Å; T233-A235 WeakPolarHBondContact CG2-O 3.39Å
236	K	36.3	Very low	34.5	Very low	146 Å²	146	92.1 Å²	92.1	64%	0.635	50%	0.501	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-122.4	114.1	165.1	-68.3	-174.6	178.2	-178.1	0	107.6	L223 T233	L223-K236 CarbonylContact O-C 3.45Å; L223-K236 WeakPolarHBondContact O-CA 3.48Å; T233-K236 HydrophobicContact CG2-CG 3.97Å
237	I	36.4	Very low	33.7	Very low	81 Å²	81	94.8 Å²	94.8	42%	0.415	53%	0.529	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	116.3	-178.4	-66.7	165.4	0	0	0	107.7	W222 L223 I225 I239	W222-I237 CarbonylContact C-O 3.57Å; W222-I237 WeakPolarHBondContact CA-O 3.46Å; L223-I237 HydrophobicContact CB-CB 4.21Å; L223-I237 HydrophobicContact CD2-CB 4.24Å; L223-I237 HydrophobicContact CD2-CD1 3.65Å; L223-I237 HydrophobicContact CD2-CG1 4.36Å; L223-I237 PolarHBondContact N-O 3.34Å; L223-I237 PolarHBondContact O-N 3.47Å; I225-I237 HydrophobicContact CD1-CD1 3.96Å; I225-I237 HydrophobicContact CG1-CD1 4.35Å; I237-I239 HydrophobicContact CG2-CG2 4.48Å; I237-I239 PolarHBondContact O-N 2.96Å
238	N	34.7	Very low	33	Very low	91 Å²	91	97.5 Å²	97.5	49%	0.487	56%	0.557	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-69.7	120.7	175.3	-169.7	-7.4	0	0	0	110	N221 S240	N221-N238 CarbonylContact O-C 3.25Å; N221-N238 WeakPolarHBondContact O-CA 3.47Å; N221-N238 PolarHBondContact O-OD1 3.24Å; N238-S240 PolarHBondContact OD1-N 2.85Å; N238-S240 PolarHBondContact OD1-OG 3.04Å
239	I	38.5	Very low	32.4	Very low	75 Å²	75	99.2 Å²	99.2	39%	0.385	58%	0.578	S	S	.	*			trans	-103.2	-0.5	174.2	59.5	168.9	0	0	0	112.4	N221 L223 I237 G241 I261	N221-I239 WeakPolarHBondContact O-CG1 3.45Å; N221-I239 PolarHBondContact O-N 3.34Å; L223-I239 HydrophobicContact CB-CG2 4.27Å; I237-I239 HydrophobicContact CG2-CG2 4.48Å; I237-I239 PolarHBondContact O-N 2.96Å; I239-G241 PolarHBondContact O-N 3.11Å; I239-I261 HydrophobicContact CD1-CD1 4.23Å
240	S	33.3	Very low	31.9	Very low	24 Å²	24	98.9 Å²	98.9	17%	0.168	59%	0.588	C	S	.	*			trans	-75.4	112	164.3	37.7	0	0	0	0	111	N221 N238 S242	N221-S240 WeakPolarHBondContact CB-OG 3.32Å; N221-S240 WeakPolarHBondContact ND2-CB 3.25Å; N221-S240 PolarHBondContact O-N 2.93Å; N238-S240 PolarHBondContact OD1-N 2.85Å; N238-S240 PolarHBondContact OD1-OG 3.04Å; S240-S242 PolarHBondContact O-N 3.26Å
241	G	32.1	Very low	31.2	Very low	51 Å²	51	97.8 Å²	97.8	53%	0.526	60%	0.595	S	S	.	*	T	Hydrogen-bonded Turn	trans	-76.2	59.4	164.3	0	0	0	0	0	112.7	I239 R259	I239-G241 PolarHBondContact O-N 3.11Å; G241-R259 PolarHBondContact O-NH1 3.33Å
242	S	26.8	Very low	30.5	Very low	86 Å²	86	98.6 Å²	98.6	60%	0.601	60%	0.599	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111.6	0.9	173.3	54.9	0	0	0	0	115.2	S240 M244	S240-S242 PolarHBondContact O-N 3.26Å; S242-M244 VanDerWaalsContact C-N 3.34Å; S242-M244 PolarHBondContact O-N 3.4Å
243	D	25.9	Very low	29.9	Very low	144 Å²	144	101.6 Å²	101.6	77%	0.77	62%	0.616	S	S	*	*			trans	-96.9	44.9	172.3	-74.2	-25.2	0	0	0	112.6
244	M	26.3	Very low	29.2	Very low	162 Å²	162	107.2 Å²	107.2	80%	0.798	64%	0.638	S	S	*	*			trans	-103.7	101.1	155.2	-80.2	-151.8	163.9	0	0	108	S242 L246	S242-M244 VanDerWaalsContact C-N 3.34Å; S242-M244 PolarHBondContact O-N 3.4Å; M244-L246 PolarHBondContact O-N 3.06Å
245	S	23.4	Very low	28.7	Very low	113 Å²	113	115.3 Å²	115.3	79%	0.79	66%	0.664	S	S	*	*			trans	-54	83.3	163.5	38.1	0	0	0	0	110	S247	S245-S247 PolarHBondContact O-N 3.38Å; S245-S247 VanDerWaalsContact O-N 3.07Å
246	L	27.1	Very low	28.2	Very low	161 Å²	161	120.9 Å²	120.9	84%	0.843	69%	0.689	S	S	*	*			trans	-80.5	75.5	166.9	-77.3	162.1	0	0	0	107.8	M244 G248	M244-L246 PolarHBondContact O-N 3.06Å; L246-G248 VanDerWaalsContact C-N 3.33Å; L246-G248 PolarHBondContact O-N 3.43Å
247	S	23.7	Very low	27.7	Very low	123 Å²	123	118.8 Å²	118.8	86%	0.86	69%	0.685	S	S	*	*			trans	-66	93.7	161.8	47.2	0	0	0	0	108.6	S245	S245-S247 PolarHBondContact O-N 3.38Å; S245-S247 VanDerWaalsContact O-N 3.07Å
248	G	25.5	Very low	27.1	Very low	58 Å²	58	120.1 Å²	120.1	60%	0.598	70%	0.701	S	S	*	*			trans	-163.8	134.2	174.9	0	0	0	0	0	110.3	L246 G250	L246-G248 VanDerWaalsContact C-N 3.33Å; L246-G248 PolarHBondContact O-N 3.43Å; G248-G250 PolarHBondContact O-N 3.28Å
249	P	25.5	Very low	26.7	Very low	141 Å²	141	123 Å²	123	92%	0.916	71%	0.705	S	S	*	*			trans	-81.6	121.9	-167.2	31.5	-31.7	0	0	0	112.2
250	G	24.7	Very low	26	Very low	72 Å²	72	127.9 Å²	127.9	74%	0.742	72%	0.719	S	S	*	*			trans	95.9	158.3	153.1	0	0	0	0	0	117.2	G248	G248-G250 PolarHBondContact O-N 3.28Å
251	P	25.7	Very low	25.7	Very low	120 Å²	120	131.7 Å²	131.7	78%	0.779	74%	0.736	S	S	*	*			cis	-124.5	155.2	-27.1	31.3	-13.4	0	0	0	112.6
252	Q	24.9	Very low	25.4	Very low	178 Å²	178	133.4 Å²	133.4	83%	0.832	73%	0.732	S	S	*	*			trans	20.7	127.8	147.9	-66.6	174.5	-11.7	0	0	119.5
253	N	25.2	Very low	25.4	Very low	150 Å²	150	132.9 Å²	132.9	80%	0.802	72%	0.722	S	S	*	*			trans	102.7	62.5	167	-55.6	-36.1	0	0	0	117.1
254	Q	26.1	Very low	25.4	Very low	183 Å²	183	134.4 Å²	134.4	86%	0.855	73%	0.725	S	S	*	*			trans	-103.1	81.8	160.8	-69.4	-160.9	7.2	0	0	111.2	N256	Q254-N256 PolarHBondContact O-N 2.88Å
255	R	25.6	Very low	25.4	Very low	226 Å²	226	130.5 Å²	130.5	85%	0.853	71%	0.713	S	S	*	*			trans	-66.9	120.8	164.9	-77.9	177.8	173.7	168.6	-1.9	109.6
256	N	25.4	Very low	25.5	Very low	153 Å²	153	128.3 Å²	128.3	82%	0.818	70%	0.695	S	S	*	*			trans	31.5	95.2	156.2	-65.5	-13.4	0	0	0	117.7	Q254 S258	Q254-N256 PolarHBondContact O-N 2.88Å; N256-S258 PolarHBondContact O-N 2.71Å
257	L	24.4	Very low	25.4	Very low	103 Å²	103	122.2 Å²	122.2	54%	0.539	67%	0.671	S	S	.	*			trans	-93.6	79.8	168.5	-90.4	150.8	0	0	0	110.7	R259	L257-R259 PolarHBondContact O-N 3.09Å; L257-R259 VanDerWaalsContact O-N 3.17Å
258	S	24.6	Very low	25.4	Very low	108 Å²	108	122.1 Å²	122.1	76%	0.755	67%	0.665	S	S	*	*			trans	-77.2	94.1	165.5	-51.4	0	0	0	0	109.4	N256 R260	N256-S258 PolarHBondContact O-N 2.71Å; S258-R260 PolarHBondContact O-N 3.35Å
259	R	26	Very low	25.4	Very low	152 Å²	152	121.9 Å²	121.9	57%	0.574	66%	0.662	S	S	*	*			trans	-78.2	104.5	176.6	-68.1	-179.9	179.4	171.2	3.9	109.3	G241 L257	G241-R259 PolarHBondContact O-NH1 3.33Å; L257-R259 PolarHBondContact O-N 3.09Å; L257-R259 VanDerWaalsContact O-N 3.17Å
260	R	24.6	Very low	25.4	Very low	178 Å²	178	119.3 Å²	119.3	67%	0.672	64%	0.641	S	S	*	*			trans	-86.1	134	173.4	-77.7	-178	176.7	-171.3	-4.6	110.8	S258 I262	S258-R260 PolarHBondContact O-N 3.35Å; R260-I262 HydrophobicContact CB-CG1 4.16Å; R260-I262 PolarHBondContact O-N 3.28Å
261	I	27	Very low	25.5	Very low	104 Å²	104	120.3 Å²	120.3	53%	0.533	63%	0.632	S	S	.	*			trans	-73.6	117.6	160.7	-61.3	171.8	0	0	0	106.6	L215 I239 D263	L215-I261 HydrophobicContact CD1-CD1 4.47Å; L215-I261 HydrophobicContact CD2-CD1 3.89Å; I239-I261 HydrophobicContact CD1-CD1 4.23Å; I261-D263 HydrophobicContact CG2-CB 4.47Å
262	I	24.7	Very low	25.5	Very low	86 Å²	86	117.8 Å²	117.8	44%	0.441	62%	0.615	S	S	.	*			trans	-112	45	-176.5	-42.1	175.2	0	0	0	109.2	R260 K289	R260-I262 HydrophobicContact CB-CG1 4.16Å; R260-I262 PolarHBondContact O-N 3.28Å; I262-K289 HydrophobicContact CD1-CD 3.6Å; I262-K289 HydrophobicContact CD1-CG 4.26Å
263	D	26.6	Very low	25.5	Very low	75 Å²	75	114.5 Å²	114.5	40%	0.401	61%	0.612	S	S	.	*			trans	-101.5	105	168.7	-161.1	-23.9	0	0	0	109.1	I261 S265 V266	I261-D263 HydrophobicContact CG2-CB 4.47Å; D263-S265 PolarHBondContact O-N 3.25Å; D263-S265 WeakPolarHBondContact OD1-CB 3.38Å; D263-S265 PolarHBondContact OD1-N 3.06Å; D263-S265 PolarHBondContact OD1-OG 3.49Å; D263-S265 PolarHBondContact OD2-OG 3.15Å; D263-V266 HydrophobicContact CB-CB 4.45Å; D263-V266 HydrophobicContact CB-CG2 4.07Å; D263-V266 PolarHBondContact O-N 2.72Å
264	H	27	Very low	25.5	Very low	177 Å²	177	109.7 Å²	109.7	82%	0.819	59%	0.585	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.2	-8.8	178.6	-60.9	-53.6	0	0	0	113
265	S	25	Very low	25.4	Very low	79 Å²	79	105.9 Å²	105.9	55%	0.552	57%	0.571	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86	-17.1	173.8	72.3	0	0	0	0	113.1	D263 G267 N270	D263-S265 PolarHBondContact O-N 3.25Å; D263-S265 WeakPolarHBondContact OD1-CB 3.38Å; D263-S265 PolarHBondContact OD1-N 3.06Å; D263-S265 PolarHBondContact OD1-OG 3.49Å; D263-S265 PolarHBondContact OD2-OG 3.15Å; S265-G267 PolarHBondContact O-N 2.99Å; S265-N270 PolarHBondContact O-ND2 3.13Å
266	V	27.1	Very low	25.4	Very low	67 Å²	67	98 Å²	98	41%	0.406	55%	0.55	S	S	.	.	S	Bend	trans	-100.6	77.8	175.5	-170.1	0	0	0	0	108	L215 D263 V268	L215-V266 HydrophobicContact CD1-CG1 3.81Å; D263-V266 HydrophobicContact CB-CB 4.45Å; D263-V266 HydrophobicContact CB-CG2 4.07Å; D263-V266 PolarHBondContact O-N 2.72Å; V266-V268 PolarHBondContact O-N 3.05Å
267	G	23.3	Very low	25.2	Very low	33 Å²	33	97.5 Å²	97.5	34%	0.34	55%	0.547	S	S	.	.			trans	-62.4	126.7	172	0	0	0	0	0	110.1	S265 G269 N270	S265-G267 PolarHBondContact O-N 2.99Å; G267-G269 PolarHBondContact O-N 3.46Å; G267-N270 PolarHBondContact N-ND2 3.21Å; G267-N270 PolarHBondContact O-N 2.68Å
268	V	25.6	Very low	25.2	Very low	121 Å²	121	95.9 Å²	95.9	73%	0.733	54%	0.542	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.8	109.3	161.1	-179.6	0	0	0	0	106.3	V266	V266-V268 PolarHBondContact O-N 3.05Å
269	G	24.2	Very low	25.1	Very low	53 Å²	53	97.7 Å²	97.7	55%	0.546	54%	0.542	S	S	.	.	T	Hydrogen-bonded Turn	trans	109.6	9.7	-175.2	0	0	0	0	0	116.7	G267 V271	G267-G269 PolarHBondContact O-N 3.46Å; G269-V271 PolarHBondContact O-N 2.95Å
270	N	25.8	Very low	24.9	Very low	88 Å²	88	94.9 Å²	94.9	47%	0.471	54%	0.537	S	S	.	.			trans	-72.4	91	168.9	-77	-14.6	0	0	0	110.7	S265 G267 V272	S265-N270 PolarHBondContact O-ND2 3.13Å; G267-N270 PolarHBondContact N-ND2 3.21Å; G267-N270 PolarHBondContact O-N 2.68Å; N270-V272 PolarHBondContact O-N 3.07Å; N270-V272 VanDerWaalsContact O-N 3.07Å
271	V	26	Very low	24.9	Very low	92 Å²	92	93.6 Å²	93.6	56%	0.558	54%	0.543	S	S	*	.			trans	-69.5	98	161.1	-180	0	0	0	0	107.1	G269 S273	G269-V271 PolarHBondContact O-N 2.95Å; V271-S273 PolarHBondContact O-N 3.1Å; V271-S273 VanDerWaalsContact O-N 3.1Å
272	V	26.5	Very low	24.7	Very low	67 Å²	67	93 Å²	93	41%	0.406	54%	0.544	S	S	.	.			trans	-77.7	96.4	167	-168.2	0	0	0	0	106.1	N270 L274	N270-V272 PolarHBondContact O-N 3.07Å; N270-V272 VanDerWaalsContact O-N 3.07Å; V272-L274 VanDerWaalsContact C-N 3.26Å; V272-L274 HydrophobicContact CB-CG 4.32Å; V272-L274 HydrophobicContact CG1-CD1 4.34Å; V272-L274 HydrophobicContact CG1-CD2 3.59Å; V272-L274 HydrophobicContact CG1-CG 3.71Å; V272-L274 PolarHBondContact O-N 2.88Å
273	S	24.8	Very low	24.7	Very low	110 Å²	110	96.4 Å²	96.4	77%	0.769	56%	0.563	S	S	*	*			trans	-68.7	92.3	170.8	-163.7	0	0	0	0	107.7	V271	V271-S273 PolarHBondContact O-N 3.1Å; V271-S273 VanDerWaalsContact O-N 3.1Å
274	L	26.1	Very low	24.6	Very low	48 Å²	48	101.1 Å²	101.1	25%	0.251	58%	0.581	S	S	.	*			trans	-85.2	131	174.5	-65.2	166.2	0	0	0	108.2	V272 T278 L280	V272-L274 VanDerWaalsContact C-N 3.26Å; V272-L274 HydrophobicContact CB-CG 4.32Å; V272-L274 HydrophobicContact CG1-CD1 4.34Å; V272-L274 HydrophobicContact CG1-CD2 3.59Å; V272-L274 HydrophobicContact CG1-CG 3.71Å; V272-L274 PolarHBondContact O-N 2.88Å; L274-T278 VanDerWaalsContact CB-O 3.22Å; L274-T278 WeakPolarHBondContact CB-O 3.39Å; L274-T278 WeakPolarHBondContact CD1-O 3.28Å; L274-T278 HydrophobicContact CD2-CG2 4.13Å; L274-L280 HydrophobicContact CD1-CB 3.6Å; L274-L280 HydrophobicContact CD2-CB 3.56Å; L274-L280 HydrophobicContact CD2-CD1 3.74Å; L274-L280 HydrophobicContact CD2-CG 4.27Å; L274-L280 HydrophobicContact CG-CB 4.19Å
275	N	22.8	Very low	24.4	Very low	103 Å²	103	97.6 Å²	97.6	55%	0.551	57%	0.571	S	S	*	*			trans	-54.5	145.4	164.1	-175	8.4	0	0	0	107.8	N277 T278	N275-N277 PolarHBondContact O-N 3.41Å; N275-T278 PolarHBondContact O-N 2.9Å
276	C	25.1	Very low	24.3	Very low	61 Å²	61	100.8 Å²	100.8	41%	0.412	58%	0.576	S	S	.	*	T	Hydrogen-bonded Turn	trans	-56.6	-0.3	-177.2	-59.7	0	0	0	0	115.1	N208	N208-C276 WeakPolarHBondContact OD1-CB 3.17Å; N208-C276 PolarHBondContact OD1-SG 3.45Å
277	N	22.8	Very low	24.1	Very low	143 Å²	143	104.1 Å²	104.1	77%	0.765	59%	0.59	S	S	*	*	T	Hydrogen-bonded Turn	trans	-113.2	15.4	178.3	-60.2	-7.4	0	0	0	112.7	N275	N275-N277 PolarHBondContact O-N 3.41Å
278	T	22.9	Very low	24.1	Very low	68 Å²	68	106.3 Å²	106.3	42%	0.417	60%	0.598	S	S	.	*			trans	-138.9	109.2	-174.9	-41.5	0	0	0	0	109.7	L274 N275	L274-T278 VanDerWaalsContact CB-O 3.22Å; L274-T278 WeakPolarHBondContact CB-O 3.39Å; L274-T278 WeakPolarHBondContact CD1-O 3.28Å; L274-T278 HydrophobicContact CD2-CG2 4.13Å; N275-T278 PolarHBondContact O-N 2.9Å
279	I	22.8	Very low	23.9	Very low	147 Å²	147	108.5 Å²	108.5	75%	0.754	60%	0.598	S	S	*	*			trans	-91.9	113.6	165.8	-63.2	173.6	0	0	0	105.8	L281	I279-L281 HydrophobicContact CG2-CG 4.12Å; I279-L281 PolarHBondContact O-N 2.73Å
280	L	23	Very low	23.9	Very low	92 Å²	92	109.9 Å²	109.9	48%	0.482	60%	0.604	S	S	.	*			trans	-95.9	92.7	171.6	-142.6	120.9	0	0	0	106.9	L274 T282	L274-L280 HydrophobicContact CD1-CB 3.6Å; L274-L280 HydrophobicContact CD2-CB 3.56Å; L274-L280 HydrophobicContact CD2-CD1 3.74Å; L274-L280 HydrophobicContact CD2-CG 4.27Å; L274-L280 HydrophobicContact CG-CB 4.19Å; L280-T282 HydrophobicContact CD2-CG2 3.66Å; L280-T282 PolarHBondContact O-N 3.1Å
281	L	23.3	Very low	23.8	Very low	152 Å²	152	114.6 Å²	114.6	80%	0.796	62%	0.62	S	S	*	*			trans	-72.8	98.7	158.6	-75.1	159.9	0	0	0	105.6	I279 D283	I279-L281 HydrophobicContact CG2-CG 4.12Å; I279-L281 PolarHBondContact O-N 2.73Å; L281-D283 PolarHBondContact O-N 3.12Å; L281-D283 VanDerWaalsContact O-N 3.17Å
282	T	24.4	Very low	23.8	Very low	90 Å²	90	115.4 Å²	115.4	55%	0.552	63%	0.63	S	S	*	*			trans	-65.7	113.6	164.1	46.5	0	0	0	0	107	L280 F284	L280-T282 HydrophobicContact CD2-CG2 3.66Å; L280-T282 PolarHBondContact O-N 3.1Å; T282-F284 PolarHBondContact O-N 3.27Å
283	D	22.8	Very low	23.6	Very low	158 Å²	158	118 Å²	118	85%	0.845	65%	0.647	S	S	*	*			trans	-49.1	104.2	160	-78.7	-31.5	0	0	0	107.8	L281	L281-D283 PolarHBondContact O-N 3.12Å; L281-D283 VanDerWaalsContact O-N 3.17Å
284	F	24.7	Very low	23.7	Very low	175 Å²	175	120 Å²	120	77%	0.768	65%	0.648	S	S	*	*			trans	-91.2	116.8	169	58.6	-90.3	0	0	0	107.5	T282	T282-F284 PolarHBondContact O-N 3.27Å
285	T	22.9	Very low	23.8	Very low	102 Å²	102	122.9 Å²	122.9	63%	0.626	67%	0.673	S	S	*	*			trans	-96	107.8	171.4	-34.4	0	0	0	0	108.3	I287	T285-I287 PolarHBondContact O-N 3.43Å
286	F	23.9	Very low	23.9	Very low	146 Å²	146	123 Å²	123	64%	0.64	69%	0.688	S	S	*	*			trans	-72.9	114.3	171.6	173.6	-101	0	0	0	109.7	P288	F286-P288 HydrophobicContact CE1-CB 3.8Å; F286-P288 HydrophobicContact CE1-CG 4.05Å; F286-P288 HydrophobicContact CZ-CB 4.11Å; F286-P288 WeakPolarHBondContact O-CD 3.42Å
287	I	22.8	Very low	24.1	Very low	138 Å²	138	125.9 Å²	125.9	71%	0.708	70%	0.699	S	S	*	*			trans	-106.4	105.9	173.1	-56	176.6	0	0	0	108.5	T285 K289	T285-I287 PolarHBondContact O-N 3.43Å; I287-K289 PolarHBondContact O-N 3.02Å
288	P	22.6	Very low	24.3	Very low	79 Å²	79	123 Å²	123	51%	0.513	69%	0.688	S	S	.	*			trans	-66.7	119.6	174.5	24.3	-29.2	0	0	0	109.9	F286 A290	F286-P288 HydrophobicContact CE1-CB 3.8Å; F286-P288 HydrophobicContact CE1-CG 4.05Å; F286-P288 HydrophobicContact CZ-CB 4.11Å; F286-P288 WeakPolarHBondContact O-CD 3.42Å; P288-A290 PolarHBondContact O-N 3.43Å
289	K	22.9	Very low	24.7	Very low	166 Å²	166	125.5 Å²	125.5	72%	0.722	70%	0.703	S	S	*	*			trans	-67.3	115.9	166.8	-91.4	-166.5	-178.9	178.7	0	109.1	I262 I287 K291	I262-K289 HydrophobicContact CD1-CD 3.6Å; I262-K289 HydrophobicContact CD1-CG 4.26Å; I287-K289 PolarHBondContact O-N 3.02Å; K289-K291 PolarHBondContact O-N 3.48Å
290	A	23.1	Very low	25.1	Very low	82 Å²	82	125.5 Å²	125.5	68%	0.678	70%	0.699	S	S	*	*			trans	-58.4	130.8	166.2	0	0	0	0	0	109.4	P288 S292	P288-A290 PolarHBondContact O-N 3.43Å; A290-S292 PolarHBondContact O-N 3.26Å
291	K	24.1	Very low	25.5	Very low	187 Å²	187	126.4 Å²	126.4	81%	0.813	70%	0.701	S	S	*	*			trans	-60.9	108.8	171.3	-82	-179.6	174.2	178.5	0	108.5	K289 T293	K289-K291 PolarHBondContact O-N 3.48Å; K291-T293 PolarHBondContact O-N 2.83Å
292	S	25.8	Very low	25.9	Very low	110 Å²	110	124.6 Å²	124.6	77%	0.769	69%	0.688	S	S	*	*			trans	-73.8	106.1	160	57.3	0	0	0	0	107.6	A290 D294	A290-S292 PolarHBondContact O-N 3.26Å; S292-D294 PolarHBondContact O-N 2.8Å
293	T	22.5	Very low	26.3	Very low	122 Å²	122	125.5 Å²	125.5	75%	0.748	68%	0.682	S	S	*	*			trans	-58.6	107	155.9	41.9	0	0	0	0	107.9	K291	K291-T293 PolarHBondContact O-N 2.83Å
294	D	25.8	Very low	26.8	Very low	150 Å²	150	126.3 Å²	126.3	80%	0.802	67%	0.673	S	S	*	*			trans	168.2	140.7	136.4	-85.4	-23.2	0	0	0	112.2	S292	S292-D294 PolarHBondContact O-N 2.8Å
295	S	27.9	Very low	27.4	Very low	110 Å²	110	120.1 Å²	120.1	77%	0.769	65%	0.654	S	S	*	*			trans	75.3	95.8	172.5	73.5	0	0	0	0	117.6	L297	S295-L297 PolarHBondContact O-N 3.4Å
296	A	25.1	Very low	28	Very low	106 Å²	106	121.2 Å²	121.2	88%	0.876	65%	0.647	S	S	*	*			trans	-66.5	106.1	161.5	0	0	0	0	0	110.2
297	L	29.6	Very low	28.6	Very low	121 Å²	121	119 Å²	119	63%	0.634	64%	0.638	S	S	*	*			trans	-92.4	127.4	155.8	-84.6	154.3	0	0	0	107.7	S295 V299	S295-L297 PolarHBondContact O-N 3.4Å; L297-V299 PolarHBondContact O-N 2.89Å
298	P	27.5	Very low	29.3	Very low	83 Å²	83	118.9 Å²	118.9	54%	0.539	64%	0.635	S	S	.	*			trans	-63.1	136.7	-175.6	23.7	-31	0	0	0	110.5	H300 Q301	P298-H300 PolarHBondContact O-N 3.39Å; P298-Q301 PolarHBondContact O-N 3.13Å
299	V	30.5	Very low	29.9	Very low	120 Å²	120	120 Å²	120	73%	0.727	64%	0.635	S	S	*	*	H	α-helix	trans	-46.1	-21.2	-176.6	176.6	0	0	0	0	114.5	L297 R303	L297-V299 PolarHBondContact O-N 2.89Å; V299-R303 PolarHBondContact O-N 3.29Å
300	H	31.7	Very low	30.6	Very low	147 Å²	147	116.9 Å²	116.9	68%	0.681	63%	0.626	S	S	*	*	H	α-helix	trans	-73.5	-29.2	173.7	-82.6	-62.3	0	0	0	115.3	P298 R304	P298-H300 PolarHBondContact O-N 3.39Å; H300-R304 PolarHBondContact O-N 3.31Å
301	Q	32.5	Very low	31.4	Very low	111 Å²	111	118 Å²	118	52%	0.519	62%	0.619	S	S	.	*	H	α-helix	trans	-78	-38	178.2	-99.3	174.5	-23.2	0	0	112.1	P298 R303 R304 A305	P298-Q301 PolarHBondContact O-N 3.13Å; Q301-R303 VanDerWaalsContact C-N 3.31Å; Q301-R303 PolarHBondContact O-N 3.49Å; Q301-R304 PolarHBondContact O-N 3Å; Q301-A305 PolarHBondContact O-N 3.5Å
302	E	31	Very low	32.1	Very low	113 Å²	113	112.7 Å²	112.7	53%	0.528	61%	0.605	S	S	.	*	H	α-helix	trans	-67.4	-34.4	175.8	-156.2	-173.6	159.3	0	0	111.6	R306	E302-R306 WeakPolarHBondContact O-CG 3.1Å; E302-R306 PolarHBondContact O-N 3.35Å; E302-R306 VanDerWaalsContact O-N 3.13Å; E302-R306 IonicContact OE1-CZ 2.79Å; E302-R306 IonicContact OE1-NE 3.87Å; E302-R306 IonicContact OE1-NH2 3.89Å; E302-R306 PolarHBondContact OE1-NH2 3.48Å
303	R	32.7	Very low	33	Very low	109 Å²	109	111.6 Å²	111.6	41%	0.411	59%	0.591	S	S	.	*	H	α-helix	trans	-67	-45.2	175.3	-148	175.9	-167	173.8	4.1	111.9	V299 Q301 A305 R306 E307 E390	V299-R303 PolarHBondContact O-N 3.29Å; Q301-R303 VanDerWaalsContact C-N 3.31Å; Q301-R303 PolarHBondContact O-N 3.49Å; R303-A305 PolarHBondContact O-N 3.37Å; R303-R306 PolarHBondContact O-N 3.42Å; R303-E307 WeakPolarHBondContact O-CG 3.33Å; R303-E307 PolarHBondContact O-N 3.44Å; R303-E390 IonicContact CZ-OE2 3.67Å; R303-E390 IonicContact NH2-OE2 2.83Å; R303-E390 PolarHBondContact NH2-OE2 2.84Å
304	R	34.3	Very low	33.9	Very low	176 Å²	176	107.8 Å²	107.8	66%	0.664	57%	0.567	S	S	*	*	H	α-helix	trans	-60.8	-43.6	173.9	-78.1	-172.2	-170.3	177.4	4.7	112.6	H300 Q301 R306 E307 E308	H300-R304 PolarHBondContact O-N 3.31Å; Q301-R304 PolarHBondContact O-N 3Å; R304-R306 VanDerWaalsContact C-N 3.31Å; R304-R306 PolarHBondContact O-N 3.43Å; R304-E307 PolarHBondContact O-N 2.86Å; R304-E308 WeakPolarHBondContact O-CB 3.46Å; R304-E308 WeakPolarHBondContact O-CG 3.28Å; R304-E308 PolarHBondContact O-N 2.96Å
305	A	35.8	Very low	34.7	Very low	44 Å²	44	102 Å²	102	36%	0.364	54%	0.538	S	S	.	.	H	α-helix	trans	-62	-38.2	178.8	0	0	0	0	0	112.2	Q301 R303 I309	Q301-A305 PolarHBondContact O-N 3.5Å; R303-A305 PolarHBondContact O-N 3.37Å; A305-I309 WeakPolarHBondContact O-CD1 3.33Å; A305-I309 VanDerWaalsContact O-CG1 3.22Å; A305-I309 WeakPolarHBondContact O-CG1 3.35Å; A305-I309 PolarHBondContact O-N 3.06Å; A305-I309 VanDerWaalsContact O-N 3.11Å
306	R	36.8	Very low	35.5	Very low	126 Å²	126	99.3 Å²	99.3	48%	0.475	52%	0.52	S	S	.	.	H	α-helix	trans	-69.8	-42.1	175.2	-73	-175.2	-171.5	174.4	11.4	112.8	E302 R303 R304 E308 I309 I310	E302-R306 WeakPolarHBondContact O-CG 3.1Å; E302-R306 PolarHBondContact O-N 3.35Å; E302-R306 VanDerWaalsContact O-N 3.13Å; E302-R306 IonicContact OE1-CZ 2.79Å; E302-R306 IonicContact OE1-NE 3.87Å; E302-R306 IonicContact OE1-NH2 3.89Å; E302-R306 PolarHBondContact OE1-NH2 3.48Å; R303-R306 PolarHBondContact O-N 3.42Å; R304-R306 VanDerWaalsContact C-N 3.31Å; R304-R306 PolarHBondContact O-N 3.43Å; R306-E308 VanDerWaalsContact C-N 3.34Å; R306-I309 PolarHBondContact O-N 2.84Å; R306-I310 WeakPolarHBondContact O-CG1 3.17Å; R306-I310 PolarHBondContact O-N 3.23Å
307	E	35.9	Very low	36.5	Very low	98 Å²	98	97.9 Å²	97.9	46%	0.458	50%	0.497	S	S	.	.	H	α-helix	trans	-60.6	-43.2	174.8	-73.2	170.7	-179.8	0	0	111.2	R303 R304 I310 I311	R303-E307 WeakPolarHBondContact O-CG 3.33Å; R303-E307 PolarHBondContact O-N 3.44Å; R304-E307 PolarHBondContact O-N 2.86Å; E307-I310 PolarHBondContact O-N 3.41Å; E307-I311 WeakPolarHBondContact O-CB 3.37Å; E307-I311 VanDerWaalsContact O-CG1 3.25Å; E307-I311 WeakPolarHBondContact O-CG1 3.47Å; E307-I311 PolarHBondContact O-N 3.1Å
308	E	36.6	Very low	37.2	Very low	136 Å²	136	93.8 Å²	93.8	64%	0.636	48%	0.475	S	S	*	.	H	α-helix	trans	-62.8	-41.3	176.3	-77.6	178.3	175.3	0	0	112.6	R304 R306 S312	R304-E308 WeakPolarHBondContact O-CB 3.46Å; R304-E308 WeakPolarHBondContact O-CG 3.28Å; R304-E308 PolarHBondContact O-N 2.96Å; R306-E308 VanDerWaalsContact C-N 3.34Å; E308-S312 WeakPolarHBondContact O-CB 3.09Å; E308-S312 PolarHBondContact O-N 3.49Å
309	I	36.2	Very low	38	Very low	102 Å²	102	95.3 Å²	95.3	52%	0.523	48%	0.475	S	S	.	.	H	α-helix	trans	-64.1	-43.7	176.8	-70.1	164	0	0	0	111.3	A305 R306 S312 N313	A305-I309 WeakPolarHBondContact O-CD1 3.33Å; A305-I309 VanDerWaalsContact O-CG1 3.22Å; A305-I309 WeakPolarHBondContact O-CG1 3.35Å; A305-I309 PolarHBondContact O-N 3.06Å; A305-I309 VanDerWaalsContact O-N 3.11Å; R306-I309 PolarHBondContact O-N 2.84Å; I309-S312 PolarHBondContact O-N 2.92Å; I309-N313 WeakPolarHBondContact O-CB 2.92Å; I309-N313 PolarHBondContact O-N 3.09Å
310	I	38.2	Very low	38.8	Very low	102 Å²	102	94 Å²	94	52%	0.523	46%	0.464	S	S	.	.	H	α-helix	trans	-65	-48.2	179.6	-67.2	166.5	0	0	0	110	R306 E307 S312 N313 V314	R306-I310 WeakPolarHBondContact O-CG1 3.17Å; R306-I310 PolarHBondContact O-N 3.23Å; E307-I310 PolarHBondContact O-N 3.41Å; I310-S312 VanDerWaalsContact C-N 3.34Å; I310-S312 PolarHBondContact O-N 3.37Å; I310-N313 PolarHBondContact O-N 2.82Å; I310-V314 HydrophobicContact CG2-CG2 4.47Å; I310-V314 VanDerWaalsContact O-CG2 3.28Å; I310-V314 WeakPolarHBondContact O-CG2 3.3Å; I310-V314 PolarHBondContact O-N 3.38Å
311	I	38.4	Very low	39.1	Very low	105 Å²	105	87.4 Å²	87.4	54%	0.538	44%	0.435	S	S	.	.	H	α-helix	trans	-60.3	-44.7	177.5	-67.7	167.3	0	0	0	110.4	E307 N313 V314 C315	E307-I311 WeakPolarHBondContact O-CB 3.37Å; E307-I311 VanDerWaalsContact O-CG1 3.25Å; E307-I311 WeakPolarHBondContact O-CG1 3.47Å; E307-I311 PolarHBondContact O-N 3.1Å; I311-N313 PolarHBondContact O-N 2.59Å; I311-V314 PolarHBondContact O-N 3.12Å; I311-C315 WeakPolarHBondContact O-CB 3.15Å; I311-C315 PolarHBondContact O-N 2.96Å; I311-C315 PolarHBondContact O-SG 3.4Å
312	S	40.4	Very low	39.5	Very low	75 Å²	75	84 Å²	84	52%	0.524	42%	0.42	S	S	.	.	H	α-helix	trans	-60.9	-41.8	178.2	-173.4	0	0	0	0	112.4	E308 I309 I310 C315 S316	E308-S312 WeakPolarHBondContact O-CB 3.09Å; E308-S312 PolarHBondContact O-N 3.49Å; I309-S312 PolarHBondContact O-N 2.92Å; I310-S312 VanDerWaalsContact C-N 3.34Å; I310-S312 PolarHBondContact O-N 3.37Å; S312-C315 PolarHBondContact O-N 2.98Å; S312-S316 WeakPolarHBondContact O-CB 3.09Å; S312-S316 PolarHBondContact O-N 3.18Å
313	N	43	Very low	40	Very low	87 Å²	87	82.8 Å²	82.8	47%	0.465	42%	0.42	S	S	.	.	H	α-helix	trans	-69.1	-40.6	178.5	-79.1	-16.7	0	0	0	112.4	I309 I310 I311 N317 L342	I309-N313 WeakPolarHBondContact O-CB 2.92Å; I309-N313 PolarHBondContact O-N 3.09Å; I310-N313 PolarHBondContact O-N 2.82Å; I311-N313 PolarHBondContact O-N 2.59Å; N313-N317 WeakPolarHBondContact O-CB 3Å; N313-N317 VanDerWaalsContact O-CG 3.28Å; N313-N317 PolarHBondContact O-N 3.5Å; N313-N317 VanDerWaalsContact O-N 3.09Å; N313-N317 PolarHBondContact O-ND2 3.21Å; N313-L342 HydrophobicContact CB-CD2 4.5Å
314	V	42	Very low	40.3	Very low	42 Å²	42	80 Å²	80	26%	0.255	42%	0.416	S	S	.	.	H	α-helix	trans	-61.3	-47.2	173.8	175.7	0	0	0	0	110.2	I310 I311 N317 M318 L342	I310-V314 HydrophobicContact CG2-CG2 4.47Å; I310-V314 VanDerWaalsContact O-CG2 3.28Å; I310-V314 WeakPolarHBondContact O-CG2 3.3Å; I310-V314 PolarHBondContact O-N 3.38Å; I311-V314 PolarHBondContact O-N 3.12Å; V314-N317 PolarHBondContact O-N 2.77Å; V314-M318 HydrophobicContact CG1-CE 4.33Å; V314-M318 HydrophobicContact CG1-SD 4.4Å; V314-M318 WeakPolarHBondContact O-CG 3.21Å; V314-M318 PolarHBondContact O-N 3.44Å; V314-L342 HydrophobicContact CB-CD1 4.48Å; V314-L342 HydrophobicContact CB-CD2 4.49Å; V314-L342 HydrophobicContact CG2-CD1 3.76Å; V314-L342 HydrophobicContact CG2-CD2 3.45Å; V314-L342 VanDerWaalsContact CG2-CD2 3.45Å; V314-L342 HydrophobicContact CG2-CG 4.28Å
315	C	41.8	Very low	40.2	Very low	29 Å²	29	72.2 Å²	72.2	20%	0.196	39%	0.388	C	S	.	.	H	α-helix	trans	-64.6	-44.6	-179.2	-65.5	0	0	0	0	111.9	I311 S312 N317 M318 E319 C366	I311-C315 WeakPolarHBondContact O-CB 3.15Å; I311-C315 PolarHBondContact O-N 2.96Å; I311-C315 PolarHBondContact O-SG 3.4Å; S312-C315 PolarHBondContact O-N 2.98Å; C315-N317 VanDerWaalsContact C-N 3.33Å; C315-N317 PolarHBondContact O-N 2.92Å; C315-M318 PolarHBondContact O-N 2.8Å; C315-E319 PolarHBondContact O-N 2.85Å; C315-C366 HydrophobicContact CB-CB 3.79Å; C315-C366 PolarHBondContact SG-SG 3.38Å
316	S	46.4	Very low	40.5	Very low	54 Å²	54	77 Å²	77	38%	0.378	40%	0.401	S	S	.	.	H	α-helix	trans	-63	-38.7	177.8	-177	0	0	0	0	112.4	S312 E319 N320	S312-S316 WeakPolarHBondContact O-CB 3.09Å; S312-S316 PolarHBondContact O-N 3.18Å; S316-E319 PolarHBondContact O-N 2.87Å; S316-N320 WeakPolarHBondContact O-CB 3.37Å; S316-N320 PolarHBondContact O-N 3.47Å; S316-N320 PolarHBondContact O-ND2 2.73Å
317	N	44.7	Very low	40.9	Very low	76 Å²	76	74 Å²	74	41%	0.406	40%	0.399	S	S	.	.	H	α-helix	trans	-69.7	-35.9	176.6	-73.5	-27	0	0	0	111.9	N313 V314 C315 A321	N313-N317 WeakPolarHBondContact O-CB 3Å; N313-N317 VanDerWaalsContact O-CG 3.28Å; N313-N317 PolarHBondContact O-N 3.5Å; N313-N317 VanDerWaalsContact O-N 3.09Å; N313-N317 PolarHBondContact O-ND2 3.21Å; V314-N317 PolarHBondContact O-N 2.77Å; C315-N317 VanDerWaalsContact C-N 3.33Å; C315-N317 PolarHBondContact O-N 2.92Å; N317-A321 WeakPolarHBondContact O-CB 3.38Å; N317-A321 PolarHBondContact O-N 2.73Å; N317-A321 VanDerWaalsContact O-N 3.12Å
318	M	44.2	Very low	40.7	Very low	35 Å²	35	72.1 Å²	72.1	17%	0.172	41%	0.406	C	S	.	.	H	α-helix	trans	-68.3	-37.7	171.6	-78.8	-172.3	171.1	0	0	113	V314 C315 A321 L322 L356 F358	V314-M318 HydrophobicContact CG1-CE 4.33Å; V314-M318 HydrophobicContact CG1-SD 4.4Å; V314-M318 WeakPolarHBondContact O-CG 3.21Å; V314-M318 PolarHBondContact O-N 3.44Å; C315-M318 PolarHBondContact O-N 2.8Å; M318-A321 WeakPolarHBondContact O-CB 3.29Å; M318-A321 PolarHBondContact O-N 3.5Å; M318-L322 WeakPolarHBondContact O-CD1 3.5Å; M318-L322 WeakPolarHBondContact O-CG 3.39Å; M318-L322 PolarHBondContact O-N 3.45Å; M318-L356 HydrophobicContact CE-CD1 3.87Å; M318-F358 HydrophobicContact CE-CE1 4.4Å; M318-F358 HydrophobicContact CE-CE2 3.8Å; M318-F358 HydrophobicContact CE-CZ 3.39Å; M318-F358 HydrophobicContact SD-CZ 4.37Å
319	E	45.4	Very low	40.6	Very low	115 Å²	115	75.3 Å²	75.3	54%	0.537	41%	0.412	S	S	.	.	H	α-helix	trans	-66.7	-46	176.5	-77.6	-173.3	163.2	0	0	111.4	C315 S316 A321 L322 T323	C315-E319 PolarHBondContact O-N 2.85Å; S316-E319 PolarHBondContact O-N 2.87Å; E319-A321 PolarHBondContact O-N 3.19Å; E319-L322 PolarHBondContact O-N 3.12Å; E319-L322 VanDerWaalsContact O-N 3.11Å; E319-T323 PolarHBondContact O-N 3.02Å; E319-T323 PolarHBondContact O-OG1 2.81Å
320	N	46	Very low	40.5	Very low	93 Å²	93	76.5 Å²	76.5	50%	0.497	41%	0.411	S	S	.	.	H	α-helix	trans	-56	-39.4	174.8	-77.8	-22.7	0	0	0	111.6	S316 T323 T324	S316-N320 WeakPolarHBondContact O-CB 3.37Å; S316-N320 PolarHBondContact O-N 3.47Å; S316-N320 PolarHBondContact O-ND2 2.73Å; N320-T323 VanDerWaalsContact C-OG1 3.31Å; N320-T323 VanDerWaalsContact CA-OG1 3.28Å; N320-T323 WeakPolarHBondContact CA-OG1 3.37Å; N320-T323 PolarHBondContact O-N 3.37Å; N320-T323 PolarHBondContact O-OG1 2.79Å; N320-T324 PolarHBondContact O-N 3.3Å; N320-T324 PolarHBondContact O-OG1 2.87Å
321	A	39.4	Very low	40.3	Very low	7 Å²	7	81.1 Å²	81.1	6%	0.058	43%	0.43	C	S	.	.	H	α-helix	trans	-56	-50.5	174.5	0	0	0	0	0	114.4	N317 M318 E319 T324 C325 Y337	N317-A321 WeakPolarHBondContact O-CB 3.38Å; N317-A321 PolarHBondContact O-N 2.73Å; N317-A321 VanDerWaalsContact O-N 3.12Å; M318-A321 WeakPolarHBondContact O-CB 3.29Å; M318-A321 PolarHBondContact O-N 3.5Å; E319-A321 PolarHBondContact O-N 3.19Å; A321-T324 PolarHBondContact O-N 2.73Å; A321-T324 VanDerWaalsContact O-N 3.15Å; A321-C325 PolarHBondContact O-N 3.35Å; A321-Y337 WeakPolarHBondContact CA-OH 3.25Å; A321-Y337 HydrophobicContact CB-CD1 4.49Å; A321-Y337 HydrophobicContact CB-CD2 4.02Å; A321-Y337 HydrophobicContact CB-CE1 3.67Å; A321-Y337 HydrophobicContact CB-CE2 3.13Å; A321-Y337 WeakPolarHBondContact CB-OH 3.41Å
322	L	40.4	Very low	40	Very low	39 Å²	39	82 Å²	82	20%	0.204	44%	0.436	C	S	.	.	H	α-helix	trans	-71.4	-35.6	-175	-66.5	148	0	0	0	111.1	M318 E319 T324 C325 K326 P364	M318-L322 WeakPolarHBondContact O-CD1 3.5Å; M318-L322 WeakPolarHBondContact O-CG 3.39Å; M318-L322 PolarHBondContact O-N 3.45Å; E319-L322 PolarHBondContact O-N 3.12Å; E319-L322 VanDerWaalsContact O-N 3.11Å; L322-T324 VanDerWaalsContact C-N 3.27Å; L322-T324 PolarHBondContact O-N 3.42Å; L322-C325 PolarHBondContact O-N 3.19Å; L322-K326 WeakPolarHBondContact O-CB 3.06Å; L322-K326 WeakPolarHBondContact O-CG 3.06Å; L322-K326 PolarHBondContact O-N 2.87Å; L322-P364 VanDerWaalsContact CD1-CD 3.44Å; L322-P364 HydrophobicContact CD1-CG 3.15Å; L322-P364 HydrophobicContact CD2-CG 4.04Å; L322-P364 HydrophobicContact CG-CG 4.13Å
323	T	40.7	Very low	39.5	Very low	88 Å²	88	84.3 Å²	84.3	54%	0.54	44%	0.442	S	S	.	.	H	α-helix	trans	-61.9	-37.8	170.6	28.2	0	0	0	0	111.7	E319 N320 S327	E319-T323 PolarHBondContact O-N 3.02Å; E319-T323 PolarHBondContact O-OG1 2.81Å; N320-T323 VanDerWaalsContact C-OG1 3.31Å; N320-T323 VanDerWaalsContact CA-OG1 3.28Å; N320-T323 WeakPolarHBondContact CA-OG1 3.37Å; N320-T323 PolarHBondContact O-N 3.37Å; N320-T323 PolarHBondContact O-OG1 2.79Å; T323-S327 WeakPolarHBondContact O-CB 3.06Å; T323-S327 PolarHBondContact O-N 3.22Å; T323-S327 VanDerWaalsContact O-N 3.09Å
324	T	39.5	Very low	39	Very low	52 Å²	52	85.7 Å²	85.7	32%	0.319	44%	0.444	S	S	.	.	H	α-helix	trans	-71.3	-38.8	177.5	-41.8	0	0	0	0	111.2	N320 A321 L322 S327 Y330	N320-T324 PolarHBondContact O-N 3.3Å; N320-T324 PolarHBondContact O-OG1 2.87Å; A321-T324 PolarHBondContact O-N 2.73Å; A321-T324 VanDerWaalsContact O-N 3.15Å; L322-T324 VanDerWaalsContact C-N 3.27Å; L322-T324 PolarHBondContact O-N 3.42Å; T324-S327 PolarHBondContact O-N 2.83Å; T324-S327 PolarHBondContact O-OG 3.49Å; T324-Y330 HydrophobicContact CG2-CE2 3.95Å
325	C	33.1	Very low	38.3	Very low	11 Å²	11	84.2 Å²	84.2	7%	0.074	44%	0.436	C	S	.	.	H	α-helix	trans	-63.8	-43.3	173.6	-155.6	0	0	0	0	112	A321 L322 S327 G328 C360	A321-C325 PolarHBondContact O-N 3.35Å; L322-C325 PolarHBondContact O-N 3.19Å; C325-S327 VanDerWaalsContact C-N 3.27Å; C325-S327 PolarHBondContact O-N 3.26Å; C325-G328 PolarHBondContact O-N 3.36Å; C325-C360 WeakPolarHBondContact CB-SG 3.23Å; C325-C360 WeakPolarHBondContact SG-CB 3.42Å; C325-C360 CovalentContact SG-SG 2.03Å; C325-C360 PolarHBondContact SG-SG 3.31Å
326	K	41.7	Very low	37.7	Very low	145 Å²	145	90 Å²	90	63%	0.63	45%	0.454	S	S	*	.	H	α-helix	trans	-68	-21.3	175.2	-76.1	-179.4	179.2	-177.9	0	114.4	L322 G328	L322-K326 WeakPolarHBondContact O-CB 3.06Å; L322-K326 WeakPolarHBondContact O-CG 3.06Å; L322-K326 PolarHBondContact O-N 2.87Å; K326-G328 PolarHBondContact O-N 3.12Å
327	S	44.2	Very low	36.9	Very low	63 Å²	63	90.4 Å²	90.4	44%	0.441	45%	0.448	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.9	5.5	178.6	73.6	0	0	0	0	114.1	T323 T324 C325 R329	T323-S327 WeakPolarHBondContact O-CB 3.06Å; T323-S327 PolarHBondContact O-N 3.22Å; T323-S327 VanDerWaalsContact O-N 3.09Å; T324-S327 PolarHBondContact O-N 2.83Å; T324-S327 PolarHBondContact O-OG 3.49Å; C325-S327 VanDerWaalsContact C-N 3.27Å; C325-S327 PolarHBondContact O-N 3.26Å; S327-R329 PolarHBondContact O-N 2.87Å; S327-R329 WeakPolarHBondContact OG-CG 3.04Å
328	G	32.1	Very low	36.2	Very low	58 Å²	58	90.8 Å²	90.8	60%	0.598	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.3	11.1	179.2	0	0	0	0	0	114.1	C325 K326 Y330	C325-G328 PolarHBondContact O-N 3.36Å; K326-G328 PolarHBondContact O-N 3.12Å; G328-Y330 VanDerWaalsContact C-N 3.27Å; G328-Y330 PolarHBondContact O-N 2.69Å
329	R	34.9	Very low	35.5	Very low	204 Å²	204	91.4 Å²	91.4	77%	0.77	45%	0.453	S	S	*	.			trans	-80.1	-5	179.7	-71	-170.7	-167.1	-168.3	4.9	114.2	S327	S327-R329 PolarHBondContact O-N 2.87Å; S327-R329 WeakPolarHBondContact OG-CG 3.04Å
330	Y	33.4	Very low	34.7	Very low	126 Å²	126	91.2 Å²	91.2	49%	0.494	45%	0.45	S	S	.	.			trans	-117.6	114.3	170.2	-73.2	-83.3	0	0	0	107.7	T324 G328 D332	T324-Y330 HydrophobicContact CG2-CE2 3.95Å; G328-Y330 VanDerWaalsContact C-N 3.27Å; G328-Y330 PolarHBondContact O-N 2.69Å; Y330-D332 PolarHBondContact O-N 3.35Å
331	Q	34	Very low	33.8	Very low	200 Å²	200	90 Å²	90	94%	0.935	46%	0.46	S	S	*	.	S	Bend	trans	-77.7	-7.7	178.2	-88.2	-178.9	-25.2	0	0	113.2
332	D	33	Very low	33.3	Very low	122 Å²	122	92.1 Å²	92.1	65%	0.652	47%	0.47	S	S	*	.	S	Bend	trans	-110.6	133.5	174.9	-73.6	-41.3	0	0	0	109.9	Y330 K334	Y330-D332 PolarHBondContact O-N 3.35Å; D332-K334 PolarHBondContact O-N 2.03Å
333	D	30.3	Very low	32.8	Very low	125 Å²	125	96.8 Å²	96.8	67%	0.668	49%	0.489	S	S	*	.	S	Bend	trans	-60.1	14.1	176.8	-76	-35.5	0	0	0	115.1	C360	D333-C360 PolarHBondContact O-N 2.75Å
334	K	31.1	Very low	32.1	Very low	116 Å²	116	95.8 Å²	95.8	50%	0.504	50%	0.496	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	101.8	-173.3	-62	176.6	-173.8	169.6	0	109.2	D332 W336	D332-K334 PolarHBondContact O-N 2.03Å; K334-W336 HydrophobicContact CD-CZ2 4.38Å
335	A	27.9	Very low	31.6	Very low	11 Å²	11	98 Å²	98	9%	0.091	51%	0.505	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	119.1	167.1	0	0	0	0	0	109.1	Y337	A335-Y337 HydrophobicContact CB-CE2 4.32Å
336	W	29.9	Very low	31.5	Very low	149 Å²	149	105.5 Å²	105.5	56%	0.564	54%	0.539	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.5	113.9	177.9	-59.4	83.1	0	0	0	108.8	K334 V355	K334-W336 HydrophobicContact CD-CZ2 4.38Å; W336-V355 HydrophobicContact CD2-CG1 4.45Å; W336-V355 HydrophobicContact CE3-CB 4.47Å; W336-V355 HydrophobicContact CE3-CG1 3.26Å; W336-V355 HydrophobicContact CE3-CG2 4.43Å; W336-V355 HydrophobicContact CZ3-CG1 3.54Å
337	Y	29.8	Very low	31	Very low	64 Å²	64	105.7 Å²	105.7	25%	0.251	54%	0.542	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	110.2	170.7	-88.7	-91.9	0	0	0	110.1	A321 A335 L356	A321-Y337 WeakPolarHBondContact CA-OH 3.25Å; A321-Y337 HydrophobicContact CB-CD1 4.49Å; A321-Y337 HydrophobicContact CB-CD2 4.02Å; A321-Y337 HydrophobicContact CB-CE1 3.67Å; A321-Y337 HydrophobicContact CB-CE2 3.13Å; A321-Y337 WeakPolarHBondContact CB-OH 3.41Å; A335-Y337 HydrophobicContact CB-CE2 4.32Å; Y337-L356 PolarHBondContact N-O 3.34Å; Y337-L356 PolarHBondContact O-N 3.28Å
338	I	29.1	Very low	30.1	Very low	84 Å²	84	104.2 Å²	104.2	43%	0.431	53%	0.53	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	120.2	167.2	-55.8	177	0	0	0	106.7	K340 A353	I338-K340 HydrophobicContact CG2-CB 3.81Å; I338-K340 HydrophobicContact CG2-CD 3.73Å; I338-K340 HydrophobicContact CG2-CG 3.49Å; I338-K340 VanDerWaalsContact CG2-CG 3.49Å; I338-K340 PolarHBondContact O-N 3.21Å; I338-A353 HydrophobicContact CG2-CB 4.07Å
339	L	30.4	Very low	29.8	Very low	48 Å²	48	105.4 Å²	105.4	25%	0.251	52%	0.523	S	S	.	.	G	3₁₀ helix	trans	-63.3	24.4	173.2	-89.7	150.1	0	0	0	114.2	G341 L342 F343 V354 L356	L339-G341 PolarHBondContact O-N 2.73Å; L339-L342 HydrophobicContact CD2-CB 3.85Å; L339-L342 HydrophobicContact CD2-CD1 3.27Å; L339-L342 HydrophobicContact CD2-CG 4.14Å; L339-L342 HydrophobicContact CG-CD1 4.47Å; L339-L342 PolarHBondContact O-N 2.96Å; L339-F343 HydrophobicContact CD2-CE2 4.29Å; L339-V354 HydrophobicContact CD1-CB 3.84Å; L339-V354 HydrophobicContact CD1-CG1 3.69Å; L339-L356 HydrophobicContact CD1-CD1 4.03Å; L339-L356 HydrophobicContact CD1-CG 4.19Å; L339-L356 HydrophobicContact CG-CD1 4.44Å
340	K	27.4	Very low	29.4	Very low	110 Å²	110	105.1 Å²	105.1	48%	0.478	52%	0.522	S	S	.	.	G	3₁₀ helix	trans	-60.8	-25.4	-179.5	-100.9	176.5	-176.6	-175.3	0	113.3	I338	I338-K340 HydrophobicContact CG2-CB 3.81Å; I338-K340 HydrophobicContact CG2-CD 3.73Å; I338-K340 HydrophobicContact CG2-CG 3.49Å; I338-K340 VanDerWaalsContact CG2-CG 3.49Å; I338-K340 PolarHBondContact O-N 3.21Å
341	G	27.5	Very low	29	Very low	68 Å²	68	106 Å²	106	70%	0.701	53%	0.528	S	S	*	.	G	3₁₀ helix	trans	-95.9	-14.3	-175.1	0	0	0	0	0	116	L339	L339-G341 PolarHBondContact O-N 2.73Å
342	L	29.7	Very low	28.7	Very low	52 Å²	52	101 Å²	101	27%	0.272	51%	0.508	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.9	-15.8	-169.9	-92.2	151.6	0	0	0	114	N313 V314 L339	N313-L342 HydrophobicContact CB-CD2 4.5Å; V314-L342 HydrophobicContact CB-CD1 4.48Å; V314-L342 HydrophobicContact CB-CD2 4.49Å; V314-L342 HydrophobicContact CG2-CD1 3.76Å; V314-L342 HydrophobicContact CG2-CD2 3.45Å; V314-L342 VanDerWaalsContact CG2-CD2 3.45Å; V314-L342 HydrophobicContact CG2-CG 4.28Å; L339-L342 HydrophobicContact CD2-CB 3.85Å; L339-L342 HydrophobicContact CD2-CD1 3.27Å; L339-L342 HydrophobicContact CD2-CG 4.14Å; L339-L342 HydrophobicContact CG-CD1 4.47Å; L339-L342 PolarHBondContact O-N 2.96Å
343	F	29.6	Very low	28.4	Very low	137 Å²	137	96.3 Å²	96.3	60%	0.601	49%	0.486	S	S	*	.	S	Bend	trans	-127.2	4.2	-173.8	-67.2	-77.2	0	0	0	114.8	L339 L345	L339-F343 HydrophobicContact CD2-CE2 4.29Å; F343-L345 HydrophobicContact CB-CD1 3.59Å; F343-L345 HydrophobicContact CB-CG 3.67Å; F343-L345 HydrophobicContact CG-CD1 4.32Å; F343-L345 PolarHBondContact O-N 3.42Å; F343-L345 VanDerWaalsContact O-N 3.12Å
344	G	26.6	Very low	28.4	Very low	66 Å²	66	93.9 Å²	93.9	68%	0.68	48%	0.476	S	S	*	.			trans	62.3	17.7	-176.5	0	0	0	0	0	114	Q346	G344-Q346 PolarHBondContact O-N 3.35Å; G344-Q346 VanDerWaalsContact O-N 3.13Å
345	L	28.9	Very low	28.2	Very low	98 Å²	98	91.6 Å²	91.6	51%	0.513	47%	0.471	S	S	.	.			trans	-77.5	96.8	-178.5	-65.5	167.5	0	0	0	109.6	F343 H347 V348	F343-L345 HydrophobicContact CB-CD1 3.59Å; F343-L345 HydrophobicContact CB-CG 3.67Å; F343-L345 HydrophobicContact CG-CD1 4.32Å; F343-L345 PolarHBondContact O-N 3.42Å; F343-L345 VanDerWaalsContact O-N 3.12Å; L345-H347 PolarHBondContact O-N 2.79Å; L345-V348 HydrophobicContact CB-CG2 3.73Å; L345-V348 HydrophobicContact CD1-CG2 4.3Å
346	Q	30.4	Very low	28.3	Very low	170 Å²	170	94 Å²	94	79%	0.794	48%	0.482	S	S	*	.	S	Bend	trans	-77	-7.2	176	-74	-169.9	-14.8	0	0	113.7	G344	G344-Q346 PolarHBondContact O-N 3.35Å; G344-Q346 VanDerWaalsContact O-N 3.13Å
347	H	30	Very low	28.3	Very low	148 Å²	148	93.9 Å²	93.9	69%	0.685	49%	0.486	S	S	*	.			trans	-126.9	69.7	178.3	-69.8	-71.5	0	0	0	110.8	L345	L345-H347 PolarHBondContact O-N 2.79Å
348	V	26	Very low	28.3	Very low	33 Å²	33	94.1 Å²	94.1	20%	0.2	49%	0.488	C	S	.	.			trans	-98.6	108	161.8	-179.9	0	0	0	0	106.2	L345 W350 D352 A353	L345-V348 HydrophobicContact CB-CG2 3.73Å; L345-V348 HydrophobicContact CD1-CG2 4.3Å; V348-W350 PolarHBondContact O-N 3.32Å; V348-D352 HydrophobicContact CG1-CB 4.42Å; V348-A353 HydrophobicContact CG1-CB 3.96Å
349	N	27	Very low	28.4	Very low	83 Å²	83	94.2 Å²	94.2	44%	0.444	49%	0.493	S	S	.	.			trans	-54.9	136.4	164.7	-151.5	-12.8	0	0	0	106.3	K351 D352	N349-K351 PolarHBondContact O-N 2.94Å; N349-D352 HydrophobicContact CB-CB 4.45Å; N349-D352 WeakPolarHBondContact CB-OD2 3.47Å; N349-D352 WeakPolarHBondContact O-CA 2.96Å; N349-D352 PolarHBondContact O-N 2.97Å
350	W	25.4	Very low	28.3	Very low	197 Å²	197	93.8 Å²	93.8	75%	0.746	49%	0.494	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.5	-14.7	-176.8	48.7	-80.8	0	0	0	112.9	V348	V348-W350 PolarHBondContact O-N 3.32Å
351	K	25	Very low	28.5	Very low	145 Å²	145	92.1 Å²	92.1	63%	0.63	51%	0.507	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77	-19.1	171	-62.5	-172	174.9	-171.2	0	114.3	N349	N349-K351 PolarHBondContact O-N 2.94Å
352	D	28.6	Very low	28.9	Very low	95 Å²	95	95.8 Å²	95.8	51%	0.508	51%	0.506	S	S	.	.	S	Bend	trans	-111	11.8	-172.7	-48.4	-28.6	0	0	0	112	V348 N349 V354	V348-D352 HydrophobicContact CG1-CB 4.42Å; N349-D352 HydrophobicContact CB-CB 4.45Å; N349-D352 WeakPolarHBondContact CB-OD2 3.47Å; N349-D352 WeakPolarHBondContact O-CA 2.96Å; N349-D352 PolarHBondContact O-N 2.97Å; D352-V354 PolarHBondContact O-N 3.2Å
353	A	26.9	Very low	29	Very low	24 Å²	24	103.2 Å²	103.2	20%	0.198	53%	0.531	C	S	.	.			trans	-80.1	120.4	179	0	0	0	0	0	111	I338 V348 V355	I338-A353 HydrophobicContact CG2-CB 4.07Å; V348-A353 HydrophobicContact CG1-CB 3.96Å; A353-V355 PolarHBondContact O-N 3.16Å
354	V	29.2	Very low	29	Very low	74 Å²	74	98.8 Å²	98.8	45%	0.448	52%	0.516	S	S	.	.			trans	-64.4	106.8	162.4	-178.6	0	0	0	0	108.1	L339 D352	L339-V354 HydrophobicContact CD1-CB 3.84Å; L339-V354 HydrophobicContact CD1-CG1 3.69Å; D352-V354 PolarHBondContact O-N 3.2Å
355	V	28.1	Very low	29.1	Very low	68 Å²	68	100.2 Å²	100.2	41%	0.412	51%	0.511	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	116.4	176.3	169.9	0	0	0	0	109	W336 A353	W336-V355 HydrophobicContact CD2-CG1 4.45Å; W336-V355 HydrophobicContact CE3-CB 4.47Å; W336-V355 HydrophobicContact CE3-CG1 3.26Å; W336-V355 HydrophobicContact CE3-CG2 4.43Å; W336-V355 HydrophobicContact CZ3-CG1 3.54Å; A353-V355 PolarHBondContact O-N 3.16Å
356	L	29	Very low	29	Very low	60 Å²	60	97.3 Å²	97.3	31%	0.314	50%	0.498	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	114.1	163.8	-64.4	171.4	0	0	0	108.7	M318 Y337 L339 F358	M318-L356 HydrophobicContact CE-CD1 3.87Å; Y337-L356 PolarHBondContact N-O 3.34Å; Y337-L356 PolarHBondContact O-N 3.28Å; L339-L356 HydrophobicContact CD1-CD1 4.03Å; L339-L356 HydrophobicContact CD1-CG 4.19Å; L339-L356 HydrophobicContact CG-CD1 4.44Å; L356-F358 HydrophobicContact CB-CD2 4.28Å; L356-F358 HydrophobicContact CB-CE2 3.48Å; L356-F358 VanDerWaalsContact CB-CE2 3.48Å; L356-F358 HydrophobicContact CB-CZ 4Å; L356-F358 HydrophobicContact CD1-CE2 4.31Å; L356-F358 HydrophobicContact CD1-CZ 4.45Å; L356-F358 HydrophobicContact CG-CE2 4.45Å
357	K	28.9	Very low	28.8	Very low	148 Å²	148	94.9 Å²	94.9	64%	0.643	49%	0.487	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.3	122.1	175.9	-175.8	-179.4	178.1	-175.4	0	109.3
358	F	31	Very low	28.6	Very low	68 Å²	68	94.2 Å²	94.2	30%	0.298	50%	0.499	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	138.7	169.7	-60.5	-78.3	0	0	0	110.7	M318 L356	M318-F358 HydrophobicContact CE-CE1 4.4Å; M318-F358 HydrophobicContact CE-CE2 3.8Å; M318-F358 HydrophobicContact CE-CZ 3.39Å; M318-F358 HydrophobicContact SD-CZ 4.37Å; L356-F358 HydrophobicContact CB-CD2 4.28Å; L356-F358 HydrophobicContact CB-CE2 3.48Å; L356-F358 VanDerWaalsContact CB-CE2 3.48Å; L356-F358 HydrophobicContact CB-CZ 4Å; L356-F358 HydrophobicContact CD1-CE2 4.31Å; L356-F358 HydrophobicContact CD1-CZ 4.45Å; L356-F358 HydrophobicContact CG-CE2 4.45Å
359	T	31.2	Very low	28.5	Very low	86 Å²	86	97.2 Å²	97.2	53%	0.528	51%	0.514	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	123.8	170.2	2.3	0	0	0	0	109	G361 Q362	T359-G361 PolarHBondContact O-N 2.85Å; T359-Q362 PolarHBondContact O-N 2.81Å
360	C	28.7	Very low	28.4	Very low	40 Å²	40	98.6 Å²	98.6	27%	0.27	53%	0.527	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.5	130.2	175.2	-147	0	0	0	0	108.9	C325 D333	C325-C360 WeakPolarHBondContact CB-SG 3.23Å; C325-C360 WeakPolarHBondContact SG-CB 3.42Å; C325-C360 CovalentContact SG-SG 2.03Å; C325-C360 PolarHBondContact SG-SG 3.31Å; D333-C360 PolarHBondContact O-N 2.75Å
361	G	30.8	Very low	28.3	Very low	74 Å²	74	100.1 Å²	100.1	76%	0.763	53%	0.533	S	S	*	.	T	Hydrogen-bonded Turn	trans	110.9	-13.8	-179.3	0	0	0	0	0	115.9	T359	T359-G361 PolarHBondContact O-N 2.85Å
362	Q	36.8	Very low	28.3	Very low	145 Å²	145	95.5 Å²	95.5	68%	0.678	52%	0.519	S	S	*	.			trans	-96.6	127.1	167.3	-69	-173.3	-16.3	0	0	109.9	T359 P364	T359-Q362 PolarHBondContact O-N 2.81Å; Q362-P364 WeakPolarHBondContact O-CD 3.09Å
363	R	31.1	Very low	28.1	Very low	208 Å²	208	96.2 Å²	96.2	79%	0.785	53%	0.527	S	S	*	.			trans	-74.4	112.2	173.8	-85.8	-175.6	177.8	179.9	-0.8	108.9	V365	R363-V365 PolarHBondContact O-N 3.38Å
364	P	30	Very low	28	Very low	45 Å²	45	103.9 Å²	103.9	29%	0.292	56%	0.556	S	S	.	*			trans	-65.6	120.4	156.6	27.9	-32.3	0	0	0	107.6	L322 Q362 C366	L322-P364 VanDerWaalsContact CD1-CD 3.44Å; L322-P364 HydrophobicContact CD1-CG 3.15Å; L322-P364 HydrophobicContact CD2-CG 4.04Å; L322-P364 HydrophobicContact CG-CG 4.13Å; Q362-P364 WeakPolarHBondContact O-CD 3.09Å; P364-C366 PolarHBondContact O-N 2.82Å
365	V	28.1	Very low	27.9	Very low	96 Å²	96	105.6 Å²	105.6	58%	0.582	56%	0.562	S	S	*	*			trans	-87.1	88	177.1	-178	0	0	0	0	107.5	R363 Q367	R363-V365 PolarHBondContact O-N 3.38Å; V365-Q367 VanDerWaalsContact C-N 3.27Å; V365-Q367 HydrophobicContact CG1-CB 4.03Å; V365-Q367 HydrophobicContact CG1-CG 3.9Å; V365-Q367 PolarHBondContact O-N 3.36Å; V365-Q367 VanDerWaalsContact O-N 3.12Å
366	C	27.5	Very low	27.7	Very low	36 Å²	36	108.9 Å²	108.9	24%	0.243	57%	0.571	C	S	.	*			trans	-78.4	77.7	165.1	-70	0	0	0	0	108.5	C315 P364	C315-C366 HydrophobicContact CB-CB 3.79Å; C315-C366 PolarHBondContact SG-SG 3.38Å; P364-C366 PolarHBondContact O-N 2.82Å
367	Q	25.5	Very low	27.6	Very low	120 Å²	120	110.7 Å²	110.7	56%	0.561	59%	0.585	S	S	*	*			trans	-112.9	113.2	170.4	-81.3	-172.2	-10	0	0	110.3	V365 N369	V365-Q367 VanDerWaalsContact C-N 3.27Å; V365-Q367 HydrophobicContact CG1-CB 4.03Å; V365-Q367 HydrophobicContact CG1-CG 3.9Å; V365-Q367 PolarHBondContact O-N 3.36Å; V365-Q367 VanDerWaalsContact O-N 3.12Å; Q367-N369 HydrophobicContact CB-CB 4.35Å; Q367-N369 PolarHBondContact O-N 2.92Å
368	S	25.4	Very low	27.6	Very low	133 Å²	133	108.5 Å²	108.5	93%	0.93	58%	0.576	S	S	*	*			trans	-63.6	76.1	155.9	45.9	0	0	0	0	109
369	N	24.6	Very low	27.5	Very low	96 Å²	96	107.5 Å²	107.5	51%	0.513	58%	0.578	S	S	.	*			trans	-137.8	126.1	173.8	-152.7	-15.7	0	0	0	108.5	Q367 R371	Q367-N369 HydrophobicContact CB-CB 4.35Å; Q367-N369 PolarHBondContact O-N 2.92Å; N369-R371 PolarHBondContact O-N 3.46Å
370	P	25.3	Very low	27.3	Very low	112 Å²	112	110.5 Å²	110.5	73%	0.727	59%	0.586	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.4	8.2	-167.3	-19.2	31.4	0	0	0	116.4
371	R	23.6	Very low	27.2	Very low	230 Å²	230	115.3 Å²	115.3	87%	0.868	60%	0.602	S	S	*	*	T	Hydrogen-bonded Turn	trans	-124.6	6.5	-169.3	-75.6	-175	168.4	175.4	-3.2	115.5	N369	N369-R371 PolarHBondContact O-N 3.46Å
372	S	24.5	Very low	27.1	Very low	47 Å²	47	118.3 Å²	118.3	33%	0.329	59%	0.594	S	S	.	*			trans	-90.7	117.1	171.6	80.2	0	0	0	0	111.6	F374	S372-F374 VanDerWaalsContact C-N 3.26Å; S372-F374 PolarHBondContact O-N 3.12Å
373	T	23.9	Very low	26.7	Very low	111 Å²	111	115 Å²	115	68%	0.681	58%	0.584	S	S	*	*	H	α-helix	trans	-76.1	-4.3	-171.1	17.8	0	0	0	0	114.5	T377	T373-T377 PolarHBondContact O-OG1 3.11Å
374	F	25.1	Very low	26.5	Very low	185 Å²	185	108.9 Å²	108.9	81%	0.811	57%	0.569	S	S	*	*	H	α-helix	trans	-86.3	-31.4	-172.1	-152.9	-98.3	0	0	0	113.6	S372	S372-F374 VanDerWaalsContact C-N 3.26Å; S372-F374 PolarHBondContact O-N 3.12Å
375	L	26.3	Very low	26.5	Very low	109 Å²	109	111.2 Å²	111.2	57%	0.571	58%	0.578	S	S	*	*	H	α-helix	trans	-85.4	-16.2	170	-80.7	160.9	0	0	0	112.1	S379	L375-S379 WeakPolarHBondContact O-CA 3.23Å; L375-S379 WeakPolarHBondContact O-CB 3.49Å; L375-S379 PolarHBondContact O-N 3.5Å; L375-S379 PolarHBondContact O-OG 3.4Å
376	K	25.3	Very low	26.5	Very low	137 Å²	137	111.5 Å²	111.5	60%	0.596	58%	0.576	S	S	*	*	H	α-helix	trans	-71.2	-28.7	179.9	-108.1	174.7	176.2	170.5	0	114.1
377	T	26.5	Very low	26.5	Very low	99 Å²	99	114.6 Å²	114.6	61%	0.607	59%	0.586	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.2	-17.3	-179.8	22.8	0	0	0	0	113.4	T373	T373-T377 PolarHBondContact O-OG1 3.11Å
378	H	29.4	Very low	26.6	Very low	102 Å²	102	113.4 Å²	113.4	47%	0.472	58%	0.582	S	S	.	*	T	Hydrogen-bonded Turn	trans	-121.9	-8.2	-178	-70.2	15.8	0	0	0	113.4	Q380 K381 F382	H378-Q380 VanDerWaalsContact C-N 3.27Å; H378-Q380 PolarHBondContact O-N 3.47Å; H378-K381 PolarHBondContact O-N 2.82Å; H378-K381 VanDerWaalsContact O-N 3.08Å; H378-F382 WeakPolarHBondContact O-CD2 3.17Å; H378-F382 PolarHBondContact O-N 3.07Å
379	S	28.1	Very low	26.8	Very low	46 Å²	46	111 Å²	111	32%	0.322	56%	0.558	S	S	.	*	H	α-helix	trans	-63.2	-31.5	171.8	57.1	0	0	0	0	112.6	L375 K381 F382 V383	L375-S379 WeakPolarHBondContact O-CA 3.23Å; L375-S379 WeakPolarHBondContact O-CB 3.49Å; L375-S379 PolarHBondContact O-N 3.5Å; L375-S379 PolarHBondContact O-OG 3.4Å; S379-K381 VanDerWaalsContact C-N 3.34Å; S379-F382 PolarHBondContact O-N 3.24Å; S379-V383 WeakPolarHBondContact O-CB 3.19Å; S379-V383 WeakPolarHBondContact O-CG2 3.13Å; S379-V383 PolarHBondContact O-N 3.03Å
380	Q	26.2	Very low	27	Very low	150 Å²	150	112 Å²	112	70%	0.701	56%	0.559	S	S	*	*	H	α-helix	trans	-66.6	-36	172.2	-76	-176.6	-15.2	0	0	111.8	H378 V384	H378-Q380 VanDerWaalsContact C-N 3.27Å; H378-Q380 PolarHBondContact O-N 3.47Å; Q380-V384 WeakPolarHBondContact O-CB 3.43Å; Q380-V384 WeakPolarHBondContact O-CG2 3.4Å; Q380-V384 PolarHBondContact O-N 3.26Å
381	K	27.7	Very low	27.2	Very low	140 Å²	140	113 Å²	113	61%	0.609	55%	0.554	S	S	*	*	H	α-helix	trans	-70.4	-40.2	176.4	-68.8	-175.3	177.9	-177.5	0	111.9	H378 S379 V384 I385	H378-K381 PolarHBondContact O-N 2.82Å; H378-K381 VanDerWaalsContact O-N 3.08Å; S379-K381 VanDerWaalsContact C-N 3.34Å; K381-V384 PolarHBondContact O-N 3.49Å; K381-I385 WeakPolarHBondContact O-CD1 3.45Å; K381-I385 VanDerWaalsContact O-CG1 3.23Å; K381-I385 WeakPolarHBondContact O-CG1 3.29Å; K381-I385 PolarHBondContact O-N 3.27Å
382	F	27.9	Very low	27.4	Very low	138 Å²	138	105.4 Å²	105.4	61%	0.605	53%	0.53	S	S	*	.	H	α-helix	trans	-70.9	-37.6	175.8	-87.7	-86.7	0	0	0	113.2	H378 S379 I385 L386	H378-F382 WeakPolarHBondContact O-CD2 3.17Å; H378-F382 PolarHBondContact O-N 3.07Å; S379-F382 PolarHBondContact O-N 3.24Å; F382-I385 PolarHBondContact O-N 2.99Å; F382-L386 WeakPolarHBondContact O-CG 3.42Å; F382-L386 PolarHBondContact O-N 3.08Å; F382-L386 VanDerWaalsContact O-N 3.12Å
383	V	27.9	Very low	27.6	Very low	75 Å²	75	109.2 Å²	109.2	46%	0.455	55%	0.546	S	S	.	.	H	α-helix	trans	-70.2	-37.6	174	172.2	0	0	0	0	110.4	S379 L386 K387	S379-V383 WeakPolarHBondContact O-CB 3.19Å; S379-V383 WeakPolarHBondContact O-CG2 3.13Å; S379-V383 PolarHBondContact O-N 3.03Å; V383-L386 PolarHBondContact O-N 3.39Å; V383-K387 VanDerWaalsContact O-CB 3.23Å; V383-K387 WeakPolarHBondContact O-CB 3.21Å; V383-K387 PolarHBondContact O-N 3.16Å
384	V	26.9	Very low	27.8	Very low	79 Å²	79	108.8 Å²	108.8	48%	0.479	55%	0.548	S	S	.	.	H	α-helix	trans	-65.2	-37.8	175.2	168	0	0	0	0	111.6	Q380 K381 K387 L388	Q380-V384 WeakPolarHBondContact O-CB 3.43Å; Q380-V384 WeakPolarHBondContact O-CG2 3.4Å; Q380-V384 PolarHBondContact O-N 3.26Å; K381-V384 PolarHBondContact O-N 3.49Å; V384-K387 PolarHBondContact O-N 2.85Å; V384-L388 HydrophobicContact CG1-CD1 3.6Å; V384-L388 WeakPolarHBondContact O-CB 3.49Å; V384-L388 WeakPolarHBondContact O-CD1 2.98Å; V384-L388 PolarHBondContact O-N 3.29Å
385	I	29.9	Very low	27.8	Very low	94 Å²	94	103 Å²	103	48%	0.482	54%	0.535	S	S	.	.	H	α-helix	trans	-66	-43.5	174.8	-69.1	163.9	0	0	0	111.2	K381 F382 M389	K381-I385 WeakPolarHBondContact O-CD1 3.45Å; K381-I385 VanDerWaalsContact O-CG1 3.23Å; K381-I385 WeakPolarHBondContact O-CG1 3.29Å; K381-I385 PolarHBondContact O-N 3.27Å; F382-I385 PolarHBondContact O-N 2.99Å; I385-M389 WeakPolarHBondContact O-CG 3.15Å; I385-M389 PolarHBondContact O-N 2.91Å; I385-M389 VanDerWaalsContact O-N 3.11Å
386	L	28.4	Very low	27.8	Very low	103 Å²	103	106.1 Å²	106.1	54%	0.539	55%	0.551	S	S	.	*	H	α-helix	trans	-69.7	-33.5	176.8	-72.3	165	0	0	0	113	F382 V383 E390	F382-L386 WeakPolarHBondContact O-CG 3.42Å; F382-L386 PolarHBondContact O-N 3.08Å; F382-L386 VanDerWaalsContact O-N 3.12Å; V383-L386 PolarHBondContact O-N 3.39Å; L386-E390 PolarHBondContact O-N 3.48Å
387	K	27.8	Very low	27.8	Very low	101 Å²	101	102.9 Å²	102.9	44%	0.439	55%	0.551	S	S	.	*	H	α-helix	trans	-77.4	-37.3	177.7	-135.5	176.5	-177.4	-171	0	112.6	V383 V384 M389 E390 E391	V383-K387 VanDerWaalsContact O-CB 3.23Å; V383-K387 WeakPolarHBondContact O-CB 3.21Å; V383-K387 PolarHBondContact O-N 3.16Å; V384-K387 PolarHBondContact O-N 2.85Å; K387-M389 VanDerWaalsContact C-N 3.3Å; K387-E390 PolarHBondContact O-N 3.38Å; K387-E391 WeakPolarHBondContact O-CB 3.23Å; K387-E391 PolarHBondContact O-N 3.48Å
388	L	27.9	Very low	27.7	Very low	94 Å²	94	104.6 Å²	104.6	49%	0.492	55%	0.552	S	S	.	*	H	α-helix	trans	-62.7	-40.5	171.2	-108.4	101.4	0	0	0	110.3	V384 E391 L392	V384-L388 HydrophobicContact CG1-CD1 3.6Å; V384-L388 WeakPolarHBondContact O-CB 3.49Å; V384-L388 WeakPolarHBondContact O-CD1 2.98Å; V384-L388 PolarHBondContact O-N 3.29Å; L388-E391 PolarHBondContact O-N 2.87Å; L388-L392 HydrophobicContact CB-CD1 4.42Å; L388-L392 HydrophobicContact CD2-CD1 4.15Å; L388-L392 WeakPolarHBondContact O-CB 3.41Å; L388-L392 WeakPolarHBondContact O-CD1 3.36Å; L388-L392 WeakPolarHBondContact O-CG 3.32Å; L388-L392 PolarHBondContact O-N 3.03Å
389	M	29.7	Very low	27.5	Very low	84 Å²	84	103 Å²	103	41%	0.414	55%	0.55	S	S	.	.	H	α-helix	trans	-66.2	-40.3	175.4	-76.7	-171.4	150	0	0	112.5	I385 K387 L393	I385-M389 WeakPolarHBondContact O-CG 3.15Å; I385-M389 PolarHBondContact O-N 2.91Å; I385-M389 VanDerWaalsContact O-N 3.11Å; K387-M389 VanDerWaalsContact C-N 3.3Å; M389-L393 VanDerWaalsContact O-CB 3.29Å; M389-L393 WeakPolarHBondContact O-CB 3.39Å; M389-L393 WeakPolarHBondContact O-CD1 3.14Å; M389-L393 WeakPolarHBondContact O-CG 3.14Å; M389-L393 PolarHBondContact O-N 3.05Å
390	E	29.4	Very low	27.4	Very low	115 Å²	115	104.1 Å²	104.1	54%	0.537	55%	0.549	S	S	.	.	H	α-helix	trans	-65.9	-39	173.6	-90.3	-171.5	152.4	0	0	113.3	R303 L386 K387 S394	R303-E390 IonicContact CZ-OE2 3.67Å; R303-E390 IonicContact NH2-OE2 2.83Å; R303-E390 PolarHBondContact NH2-OE2 2.84Å; L386-E390 PolarHBondContact O-N 3.48Å; K387-E390 PolarHBondContact O-N 3.38Å; E390-S394 WeakPolarHBondContact O-CB 2.94Å; E390-S394 PolarHBondContact O-N 3.04Å
391	E	28.2	Very low	27.5	Very low	134 Å²	134	100.4 Å²	100.4	63%	0.626	53%	0.534	S	S	*	.	H	α-helix	trans	-78.5	-35.2	-179.9	-76.5	-177.6	-178.8	0	0	113	K387 L388 L393 S394	K387-E391 WeakPolarHBondContact O-CB 3.23Å; K387-E391 PolarHBondContact O-N 3.48Å; L388-E391 PolarHBondContact O-N 2.87Å; E391-L393 PolarHBondContact O-N 2.77Å; E391-S394 PolarHBondContact O-N 3.03Å
392	L	28.7	Very low	27.6	Very low	70 Å²	70	98 Å²	98	37%	0.366	52%	0.523	S	S	.	.	H	α-helix	trans	-68.9	-22.4	173.6	-74.3	166.6	0	0	0	113	L388 I401	L388-L392 HydrophobicContact CB-CD1 4.42Å; L388-L392 HydrophobicContact CD2-CD1 4.15Å; L388-L392 WeakPolarHBondContact O-CB 3.41Å; L388-L392 WeakPolarHBondContact O-CD1 3.36Å; L388-L392 WeakPolarHBondContact O-CG 3.32Å; L388-L392 PolarHBondContact O-N 3.03Å; L392-I401 HydrophobicContact CD2-CD1 4.14Å
393	L	28.3	Very low	27.6	Very low	128 Å²	128	93.5 Å²	93.5	67%	0.67	51%	0.505	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.1	-8.8	175.6	-69.1	168.7	0	0	0	113.3	M389 E391	M389-L393 VanDerWaalsContact O-CB 3.29Å; M389-L393 WeakPolarHBondContact O-CB 3.39Å; M389-L393 WeakPolarHBondContact O-CD1 3.14Å; M389-L393 WeakPolarHBondContact O-CG 3.14Å; M389-L393 PolarHBondContact O-N 3.05Å; E391-L393 PolarHBondContact O-N 2.77Å
394	S	28.1	Very low	27.7	Very low	101 Å²	101	92 Å²	92	71%	0.706	49%	0.494	S	S	*	.	S	Bend	trans	-103.8	-3.9	-175.1	-179.7	0	0	0	0	114.3	E390 E391	E390-S394 WeakPolarHBondContact O-CB 2.94Å; E390-S394 PolarHBondContact O-N 3.04Å; E391-S394 PolarHBondContact O-N 3.03Å
395	A	24.9	Very low	27.8	Very low	65 Å²	65	91.5 Å²	91.5	54%	0.537	49%	0.488	S	S	.	.			trans	-107.4	113.7	179.6	0	0	0	0	0	111.1	A397	A395-A397 PolarHBondContact O-N 3.04Å
396	D	26.1	Very low	27.6	Very low	173 Å²	173	91.4 Å²	91.4	93%	0.925	49%	0.488	S	S	*	.	S	Bend	trans	-70	47.6	178	-122.6	-17.3	0	0	0	112.9
397	A	25.5	Very low	27.5	Very low	70 Å²	70	90.3 Å²	90.3	58%	0.579	48%	0.483	S	S	*	.	S	Bend	trans	-152	117	178.4	0	0	0	0	0	110.5	A395 P399	A395-A397 PolarHBondContact O-N 3.04Å; A397-P399 WeakPolarHBondContact O-CD 3.5Å; A397-P399 WeakPolarHBondContact O-CG 3.46Å; A397-P399 VanDerWaalsContact O-N 3.08Å
398	E	25.1	Very low	27.4	Very low	135 Å²	135	89.8 Å²	89.8	63%	0.631	49%	0.491	S	S	*	.			trans	-49.8	107.6	175.2	-67.3	-174.7	175.1	0	0	113.1	R419 R447	E398-R419 IonicContact OE2-NH2 3.04Å; E398-R419 PolarHBondContact OE2-NH2 3.18Å; E398-R447 VanDerWaalsContact CB-NH1 3.3Å; E398-R447 PolarHBondContact O-NH1 3.04Å; E398-R447 IonicContact OE2-CZ 3.41Å; E398-R447 IonicContact OE2-NH1 3.03Å; E398-R447 PolarHBondContact OE2-NH1 3.14Å; E398-R447 IonicContact OE2-NH2 2.77Å; E398-R447 PolarHBondContact OE2-NH2 2.76Å
399	P	25.2	Very low	27.5	Very low	67 Å²	67	94.1 Å²	94.1	44%	0.435	51%	0.506	S	S	.	.			trans	-93.1	116.5	167	5.3	18.1	0	0	0	107.5	A397 I401	A397-P399 WeakPolarHBondContact O-CD 3.5Å; A397-P399 WeakPolarHBondContact O-CG 3.46Å; A397-P399 VanDerWaalsContact O-N 3.08Å; P399-I401 HydrophobicContact CB-CG1 4.4Å; P399-I401 PolarHBondContact O-N 3.16Å; P399-I401 VanDerWaalsContact O-N 3.14Å
400	K	26.5	Very low	27.4	Very low	71 Å²	71	93.5 Å²	93.5	31%	0.309	52%	0.515	S	S	.	.			trans	-76.8	95.4	169.8	-85.4	-176.2	-176.5	171.1	0	107.4	K402 R419 P446 R447	K400-K402 PolarHBondContact O-N 3.03Å; K400-R419 VanDerWaalsContact CG-CZ 3.45Å; K400-R419 VanDerWaalsContact CG-NE 3.31Å; K400-P446 HydrophobicContact CB-CG 4.47Å; K400-P446 WeakPolarHBondContact O-CD 3.25Å; K400-R447 HydrophobicContact CB-CG 4.1Å; K400-R447 HydrophobicContact CD-CG 3.96Å; K400-R447 VanDerWaalsContact CD-NE 3.26Å; K400-R447 VanDerWaalsContact CE-NH2 3.31Å; K400-R447 HydrophobicContact CG-CG 4.37Å; K400-R447 VanDerWaalsContact CG-CZ 3.48Å
401	I	27.8	Very low	27.2	Very low	72 Å²	72	93.9 Å²	93.9	37%	0.369	53%	0.53	S	S	.	.			trans	-84.3	111.3	170.2	-51.2	-168.2	0	0	0	108.1	L392 P399 L443 L452	L392-I401 HydrophobicContact CD2-CD1 4.14Å; P399-I401 HydrophobicContact CB-CG1 4.4Å; P399-I401 PolarHBondContact O-N 3.16Å; P399-I401 VanDerWaalsContact O-N 3.14Å; I401-L443 HydrophobicContact CG2-CB 4.25Å; I401-L443 HydrophobicContact CG2-CD2 3.32Å; I401-L443 HydrophobicContact CG2-CG 4.34Å; I401-L452 HydrophobicContact CB-CD1 3.7Å; I401-L452 HydrophobicContact CD1-CD1 3.92Å; I401-L452 HydrophobicContact CG1-CD1 3.43Å; I401-L452 VanDerWaalsContact CG1-CD1 3.43Å; I401-L452 HydrophobicContact CG2-CD1 3.47Å; I401-L452 VanDerWaalsContact CG2-CD1 3.47Å
402	K	29.8	Very low	27.2	Very low	89 Å²	89	93.6 Å²	93.6	39%	0.387	53%	0.533	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	161.7	167.9	-142.6	-170.2	179.7	-145.3	0	108.4	K400 D404 L443 Y444 P446	K400-K402 PolarHBondContact O-N 3.03Å; K402-D404 WeakPolarHBondContact CE-OD1 3.49Å; K402-D404 IonicContact NZ-OD1 2.85Å; K402-D404 PolarHBondContact NZ-OD1 3.1Å; K402-D404 IonicContact NZ-OD2 3.58Å; K402-L443 CarbonylContact O-C 3.44Å; K402-L443 VanDerWaalsContact O-CA 3.31Å; K402-L443 WeakPolarHBondContact O-CA 3.12Å; K402-Y444 CarbonylContact C-O 3.52Å; K402-Y444 VanDerWaalsContact C-O 3.25Å; K402-Y444 WeakPolarHBondContact CA-O 3.46Å; K402-Y444 HydrophobicContact CB-CD1 4.26Å; K402-Y444 WeakPolarHBondContact CB-O 3.26Å; K402-Y444 HydrophobicContact CD-CD1 3.5Å; K402-Y444 HydrophobicContact CD-CE1 4.18Å; K402-Y444 HydrophobicContact CD-CG 4.45Å; K402-Y444 PolarHBondContact N-O 3.38Å; K402-Y444 PolarHBondContact O-N 3.2Å; K402-P446 HydrophobicContact CB-CG 3.89Å; K402-P446 HydrophobicContact CD-CB 3.93Å; K402-P446 HydrophobicContact CD-CG 3.84Å; K402-P446 HydrophobicContact CG-CG 3.99Å
403	L	27.6	Very low	27.1	Very low	43 Å²	43	96.5 Å²	96.5	23%	0.225	56%	0.556	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-132.5	110.1	173.3	-147.5	153.5	0	0	0	107.1	I405 I425 L427 I441 H442 L443	L403-I405 HydrophobicContact CD2-CG1 4.28Å; L403-I425 HydrophobicContact CD1-CD1 4.32Å; L403-L427 HydrophobicContact CD1-CD1 4.04Å; L403-L427 HydrophobicContact CD1-CD2 4.21Å; L403-L427 HydrophobicContact CD1-CG 4.39Å; L403-L427 HydrophobicContact CD2-CD1 3.76Å; L403-L427 HydrophobicContact CD2-CD2 3.69Å; L403-L427 HydrophobicContact CD2-CG 4.32Å; L403-L427 HydrophobicContact CG-CD2 4.39Å; L403-I441 HydrophobicContact CD2-CG2 3.3Å; L403-I441 HydrophobicContact CG-CG2 4.39Å; L403-H442 CarbonylContact C-O 3.42Å; L403-H442 WeakPolarHBondContact CA-O 3.33Å; L403-L443 HydrophobicContact CB-CD2 4.21Å; L403-L443 HydrophobicContact CD1-CD2 3.44Å; L403-L443 VanDerWaalsContact CD1-CD2 3.44Å; L403-L443 HydrophobicContact CD1-CG 3.87Å; L403-L443 HydrophobicContact CG-CD2 3.73Å; L403-L443 HydrophobicContact CG-CG 3.93Å
404	D	29.8	Very low	26.8	Very low	43 Å²	43	94.8 Å²	94.8	23%	0.23	56%	0.555	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-95.9	115.3	178.2	-74.8	-24.2	0	0	0	108.2	K402 I406 H442 Y444	K402-D404 WeakPolarHBondContact CE-OD1 3.49Å; K402-D404 IonicContact NZ-OD1 2.85Å; K402-D404 PolarHBondContact NZ-OD1 3.1Å; K402-D404 IonicContact NZ-OD2 3.58Å; D404-I406 HydrophobicContact CB-CG1 4.41Å; D404-H442 PolarHBondContact N-O 3.09Å; D404-H442 PolarHBondContact O-N 3.21Å; D404-H442 VanDerWaalsContact O-N 3.08Å; D404-H442 VanDerWaalsContact O-O 3.1Å; D404-Y444 VanDerWaalsContact OD2-CB 3.25Å; D404-Y444 WeakPolarHBondContact OD2-CB 3.32Å; D404-Y444 VanDerWaalsContact OD2-CG 3.27Å
405	I	28.4	Very low	26.7	Very low	69 Å²	69	94.7 Å²	94.7	35%	0.354	56%	0.56	S	S	.	*			trans	-92.4	107.8	166.8	-62	162.5	0	0	0	106.7	L403 L427 L429 V438	L403-I405 HydrophobicContact CD2-CG1 4.28Å; I405-L427 HydrophobicContact CD1-CD2 4Å; I405-L429 HydrophobicContact CD1-CD2 3.52Å; I405-V438 HydrophobicContact CG2-CG1 4.29Å; I405-V438 HydrophobicContact CG2-CG2 4.43Å
406	I	26.3	Very low	26.7	Very low	92 Å²	92	96.7 Å²	96.7	47%	0.472	58%	0.577	S	S	.	*			trans	-94.2	106.9	-179.7	-56	179.9	0	0	0	107.5	D404 S408	D404-I406 HydrophobicContact CB-CG1 4.41Å; I406-S408 PolarHBondContact O-N 3.48Å
407	D	27.1	Very low	26.6	Very low	81 Å²	81	95.2 Å²	95.2	43%	0.433	57%	0.573	S	S	.	*			trans	-69.9	121.1	159.8	-171.3	-2.7	0	0	0	107.9	K409 A410	D407-K409 PolarHBondContact O-N 3.23Å; D407-A410 PolarHBondContact O-N 2.67Å
408	S	25.1	Very low	26.6	Very low	89 Å²	89	97.5 Å²	97.5	62%	0.622	59%	0.586	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.5	2.7	-174	62.6	0	0	0	0	115.2	I406	I406-S408 PolarHBondContact O-N 3.48Å
409	K	29.8	Very low	26.7	Very low	185 Å²	185	97.3 Å²	97.3	80%	0.804	58%	0.579	S	S	*	*	T	Hydrogen-bonded Turn	trans	-131	-4.2	-173.4	-69.4	-170.6	176.7	-177.3	0	116.3	D407	D407-K409 PolarHBondContact O-N 3.23Å
410	A	27.3	Very low	26.9	Very low	72 Å²	72	101.3 Å²	101.3	60%	0.595	59%	0.592	S	S	*	*			trans	-114.8	101.7	-174.7	0	0	0	0	0	111.7	D407 D412	D407-A410 PolarHBondContact O-N 2.67Å; A410-D412 PolarHBondContact O-N 2.8Å
411	S	25.6	Very low	27.1	Very low	123 Å²	123	105 Å²	105	86%	0.86	61%	0.61	S	S	*	*			trans	-63.5	103.4	160.8	47	0	0	0	0	110
412	D	28.7	Very low	27.3	Very low	127 Å²	127	107.4 Å²	107.4	68%	0.679	62%	0.624	S	S	*	*			trans	169.5	112.3	134	-153.6	-30.5	0	0	0	110.4	A410 S414	A410-D412 PolarHBondContact O-N 2.8Å; D412-S414 PolarHBondContact O-N 2.77Å; D412-S414 PolarHBondContact OD1-OG 2.69Å; D412-S414 VanDerWaalsContact OD1-OG 3.11Å
413	P	26.2	Very low	27.1	Very low	132 Å²	132	109.9 Å²	109.9	86%	0.857	64%	0.637	S	S	*	*			trans	-94.4	76.6	-174.7	36.4	-30.6	0	0	0	110.9
414	S	22.9	Very low	27.3	Very low	91 Å²	91	113.5 Å²	113.5	64%	0.636	66%	0.656	S	S	*	*			trans	-156.7	61.5	-178.4	55.3	0	0	0	0	115.6	D412	D412-S414 PolarHBondContact O-N 2.77Å; D412-S414 PolarHBondContact OD1-OG 2.69Å; D412-S414 VanDerWaalsContact OD1-OG 3.11Å
415	A	24.8	Very low	27.2	Very low	100 Å²	100	116.4 Å²	116.4	83%	0.826	67%	0.671	S	S	*	*			trans	-156.7	130.9	160.7	0	0	0	0	0	114.9
416	A	24.3	Very low	27.2	Very low	107 Å²	107	120 Å²	120	88%	0.884	69%	0.69	S	S	*	*			trans	79.1	141.8	158.6	0	0	0	0	0	120.6
417	V	24.2	Very low	27.4	Very low	141 Å²	141	119.1 Å²	119.1	86%	0.855	69%	0.685	S	S	*	*			trans	-127.5	141.3	-155.6	171.4	0	0	0	0	108.9
418	S	26.2	Very low	27.5	Very low	119 Å²	119	123.3 Å²	123.3	83%	0.832	70%	0.703	S	S	*	*				168.1	161.2	109.5	62.8	0	0	0	0	112.9
419	R	27.1	Very low	28	Very low	131 Å²	131	121.2 Å²	121.2	49%	0.494	68%	0.684	S	S	.	*			trans	-94.8	157.2	-173.7	-62.7	158.5	99.8	179	3.7	111.3	E398 K400	E398-R419 IonicContact OE2-NH2 3.04Å; E398-R419 PolarHBondContact OE2-NH2 3.18Å; K400-R419 VanDerWaalsContact CG-CZ 3.45Å; K400-R419 VanDerWaalsContact CG-NE 3.31Å
420	H	30	Very low	28	Very low	151 Å²	151	116.6 Å²	116.6	70%	0.699	67%	0.673	S	S	*	*				-170.5	132	126.5	-123	-99.2	0	0	0	116.8
421	Q	29.9	Very low	28.3	Very low	148 Å²	148	119.9 Å²	119.9	69%	0.692	69%	0.688	S	S	*	*	S	Bend	trans	42.9	72.3	145.2	-70	175.7	-10.6	0	0	122.1	E423	Q421-E423 VanDerWaalsContact C-N 3.34Å; Q421-E423 PolarHBondContact O-N 2.64Å
422	N	32.2	Very low	28.6	Very low	123 Å²	123	118 Å²	118	66%	0.658	69%	0.688	S	S	*	*	S	Bend	trans	51.8	38.5	146.2	-66.6	1.8	0	0	0	117.7
423	E	26.6	Very low	29	Very low	141 Å²	141	114.8 Å²	114.8	66%	0.659	67%	0.673	S	S	*	*	S	Bend	trans	-114	156.6	172.3	-72.8	176.6	169.6	0	0	110.5	Q421 I425	Q421-E423 VanDerWaalsContact C-N 3.34Å; Q421-E423 PolarHBondContact O-N 2.64Å; E423-I425 WeakPolarHBondContact O-CG1 3.31Å; E423-I425 PolarHBondContact O-N 2.74Å
424	D	30.5	Very low	29.6	Very low	118 Å²	118	114 Å²	114	63%	0.631	66%	0.662	S	S	*	*			trans	-54.9	114	170.1	-77.4	-29.7	0	0	0	108.5	L426	D424-L426 PolarHBondContact O-N 2.75Å
425	I	27.7	Very low	30.5	Very low	105 Å²	105	111.7 Å²	111.7	54%	0.538	64%	0.644	S	S	.	*			trans	-76.1	102.2	-171.6	-55.8	174.7	0	0	0	108.4	L403 E423 L427	L403-I425 HydrophobicContact CD1-CD1 4.32Å; E423-I425 WeakPolarHBondContact O-CG1 3.31Å; E423-I425 PolarHBondContact O-N 2.74Å; I425-L427 HydrophobicContact CG2-CG 4.41Å; I425-L427 PolarHBondContact O-N 3.42Å; I425-L427 VanDerWaalsContact O-N 3.16Å
426	L	28.4	Very low	31	Very low	145 Å²	145	110.6 Å²	110.6	76%	0.759	64%	0.635	S	S	*	*			trans	-65	111.1	161.6	-155.4	95.9	0	0	0	107.5	D424 E428	D424-L426 PolarHBondContact O-N 2.75Å; L426-E428 VanDerWaalsContact C-N 3.3Å; L426-E428 PolarHBondContact O-N 3.12Å
427	L	30.6	Very low	31.8	Very low	72 Å²	72	107.8 Å²	107.8	38%	0.377	62%	0.617	S	S	.	*			trans	-78.2	85.9	171.7	-78.2	155.8	0	0	0	108.3	L403 I405 I425 L429 I441	L403-L427 HydrophobicContact CD1-CD1 4.04Å; L403-L427 HydrophobicContact CD1-CD2 4.21Å; L403-L427 HydrophobicContact CD1-CG 4.39Å; L403-L427 HydrophobicContact CD2-CD1 3.76Å; L403-L427 HydrophobicContact CD2-CD2 3.69Å; L403-L427 HydrophobicContact CD2-CG 4.32Å; L403-L427 HydrophobicContact CG-CD2 4.39Å; I405-L427 HydrophobicContact CD1-CD2 4Å; I425-L427 HydrophobicContact CG2-CG 4.41Å; I425-L427 PolarHBondContact O-N 3.42Å; I425-L427 VanDerWaalsContact O-N 3.16Å; L427-L429 PolarHBondContact O-N 3.47Å; L427-I441 HydrophobicContact CD1-CG2 4.37Å
428	E	29.5	Very low	32.8	Very low	170 Å²	170	101.8 Å²	101.8	79%	0.794	58%	0.58	S	S	*	*			trans	-74.5	103.5	168.7	-155.6	174.5	-150.2	0	0	107.9	L426	L426-E428 VanDerWaalsContact C-N 3.3Å; L426-E428 PolarHBondContact O-N 3.12Å
429	L	35	Very low	33.7	Very low	44 Å²	44	101.6 Å²	101.6	23%	0.23	57%	0.565	C	S	.	*	P	Polyproline II helix	trans	-76	136.6	175.5	-62.3	155	0	0	0	107.9	I405 L427 T433 V435	I405-L429 HydrophobicContact CD1-CD2 3.52Å; L427-L429 PolarHBondContact O-N 3.47Å; L429-T433 HydrophobicContact CB-CG2 4.12Å; L429-T433 HydrophobicContact CD2-CG2 3.88Å; L429-V435 HydrophobicContact CD1-CB 4.46Å; L429-V435 HydrophobicContact CD1-CG1 3.26Å; L429-V435 HydrophobicContact CD1-CG2 4.46Å; L429-V435 HydrophobicContact CD2-CG1 4.13Å; L429-V435 HydrophobicContact CG-CG1 4.31Å
430	P	31.5	Very low	34.5	Very low	88 Å²	88	100.4 Å²	100.4	57%	0.571	56%	0.56	S	S	*	*	P	Polyproline II helix	trans	-48.4	139.9	173.9	-23.8	26.3	0	0	0	111.2	G432 T433	P430-G432 PolarHBondContact O-N 3.46Å; P430-T433 WeakPolarHBondContact CB-OG1 3.42Å; P430-T433 WeakPolarHBondContact CD-OG1 2.78Å; P430-T433 WeakPolarHBondContact CG-OG1 3.4Å; P430-T433 VanDerWaalsContact O-CB 3.23Å; P430-T433 WeakPolarHBondContact O-CB 3.02Å; P430-T433 PolarHBondContact O-N 3.22Å; P430-T433 PolarHBondContact O-OG1 3.17Å
431	P	32.4	Very low	35.3	Very low	141 Å²	141	94.6 Å²	94.6	92%	0.916	53%	0.534	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.9	125.7	171.7	-24.5	32.6	0	0	0	110.1
432	G	32.7	Very low	36	Very low	84 Å²	84	89.4 Å²	89.4	87%	0.866	51%	0.51	S	S	*	.	T	Hydrogen-bonded Turn	trans	92.4	-0.3	-173.7	0	0	0	0	0	115.7	P430 N434	P430-G432 PolarHBondContact O-N 3.46Å; G432-N434 PolarHBondContact O-N 3.12Å; G432-N434 VanDerWaalsContact O-N 3.17Å
433	T	36.4	Very low	36.6	Very low	59 Å²	59	84.9 Å²	84.9	36%	0.362	49%	0.485	S	S	.	.			trans	-70.5	112	173.6	-54.3	0	0	0	0	110	L429 P430 V435	L429-T433 HydrophobicContact CB-CG2 4.12Å; L429-T433 HydrophobicContact CD2-CG2 3.88Å; P430-T433 WeakPolarHBondContact CB-OG1 3.42Å; P430-T433 WeakPolarHBondContact CD-OG1 2.78Å; P430-T433 WeakPolarHBondContact CG-OG1 3.4Å; P430-T433 VanDerWaalsContact O-CB 3.23Å; P430-T433 WeakPolarHBondContact O-CB 3.02Å; P430-T433 PolarHBondContact O-N 3.22Å; P430-T433 PolarHBondContact O-OG1 3.17Å; T433-V435 PolarHBondContact O-N 3.15Å; T433-V435 VanDerWaalsContact O-N 3.15Å
434	N	39.2	Very low	37.2	Very low	115 Å²	115	81 Å²	81	62%	0.615	47%	0.465	S	S	*	.			trans	-77.5	101.9	178.1	-167.9	1.4	0	0	0	110.2	G432 A436	G432-N434 PolarHBondContact O-N 3.12Å; G432-N434 VanDerWaalsContact O-N 3.17Å; N434-A436 WeakPolarHBondContact OD1-CA 3.23Å; N434-A436 WeakPolarHBondContact OD1-CB 3.35Å; N434-A436 PolarHBondContact OD1-N 3.03Å
435	V	40.9	Very low	37.6	Very low	43 Å²	43	76.2 Å²	76.2	26%	0.261	44%	0.439	S	S	.	.			trans	-80.6	-5	170.8	-83.1	0	0	0	0	113.5	L429 T433 G437 V438	L429-V435 HydrophobicContact CD1-CB 4.46Å; L429-V435 HydrophobicContact CD1-CG1 3.26Å; L429-V435 HydrophobicContact CD1-CG2 4.46Å; L429-V435 HydrophobicContact CD2-CG1 4.13Å; L429-V435 HydrophobicContact CG-CG1 4.31Å; T433-V435 PolarHBondContact O-N 3.15Å; T433-V435 VanDerWaalsContact O-N 3.15Å; V435-G437 PolarHBondContact O-N 3.09Å; V435-G437 VanDerWaalsContact O-N 3.08Å; V435-V438 HydrophobicContact CB-CG2 4.43Å; V435-V438 HydrophobicContact CG1-CG2 4.36Å; V435-V438 PolarHBondContact O-N 3.5Å; V435-V438 VanDerWaalsContact O-N 3.15Å
436	A	35.9	Very low	37.9	Very low	77 Å²	77	74 Å²	74	64%	0.636	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.3	114.4	175.9	0	0	0	0	0	109.5	N434	N434-A436 WeakPolarHBondContact OD1-CA 3.23Å; N434-A436 WeakPolarHBondContact OD1-CB 3.35Å; N434-A436 PolarHBondContact OD1-N 3.03Å
437	G	41.5	Very low	38.2	Very low	49 Å²	49	72.7 Å²	72.7	51%	0.505	42%	0.417	S	S	.	.	T	Hydrogen-bonded Turn	trans	100.4	-3.4	-179.7	0	0	0	0	0	115.1	V435 K439	V435-G437 PolarHBondContact O-N 3.09Å; V435-G437 VanDerWaalsContact O-N 3.08Å; G437-K439 PolarHBondContact O-N 2.84Å; G437-K439 VanDerWaalsContact O-N 3.12Å
438	V	44.3	Very low	38.8	Very low	15 Å²	15	72.2 Å²	72.2	9%	0.091	42%	0.423	C	S	.	.			trans	-66.2	113.5	169.1	-176.9	0	0	0	0	107.9	I405 V435 W440 I441 L457	I405-V438 HydrophobicContact CG2-CG1 4.29Å; I405-V438 HydrophobicContact CG2-CG2 4.43Å; V435-V438 HydrophobicContact CB-CG2 4.43Å; V435-V438 HydrophobicContact CG1-CG2 4.36Å; V435-V438 PolarHBondContact O-N 3.5Å; V435-V438 VanDerWaalsContact O-N 3.15Å; V438-W440 VanDerWaalsContact CG1-O 3.29Å; V438-W440 WeakPolarHBondContact CG1-O 3.37Å; V438-I441 HydrophobicContact CG1-CG1 4.31Å; V438-L457 HydrophobicContact CB-CD1 3.99Å; V438-L457 HydrophobicContact CG1-CD1 3.75Å; V438-L457 VanDerWaalsContact O-CD1 3.32Å; V438-L457 WeakPolarHBondContact O-CD1 3.47Å
439	K	46	Very low	39.5	Very low	115 Å²	115	67.5 Å²	67.5	50%	0.5	41%	0.413	S	S	.	.			trans	-94.7	-22	178.5	-69.9	-179.3	-178.7	177	0	112.6	G437 Q456 L457	G437-K439 PolarHBondContact O-N 2.84Å; G437-K439 VanDerWaalsContact O-N 3.12Å; K439-Q456 WeakPolarHBondContact O-CA 3.01Å; K439-L457 PolarHBondContact O-N 3.15Å
440	W	44.4	Very low	39.7	Very low	105 Å²	105	67.3 Å²	67.3	40%	0.398	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	142.5	-173.6	-70	93.1	0	0	0	111.2	V438 F455 Q456	V438-W440 VanDerWaalsContact CG1-O 3.29Å; V438-W440 WeakPolarHBondContact CG1-O 3.37Å; W440-F455 CarbonylContact C-O 3.49Å; W440-F455 VanDerWaalsContact CA-O 3.26Å; W440-F455 WeakPolarHBondContact CA-O 3.23Å; W440-Q456 HydrophobicContact CD2-CB 4.13Å; W440-Q456 HydrophobicContact CD2-CG 4.19Å; W440-Q456 HydrophobicContact CE3-CB 3.89Å; W440-Q456 HydrophobicContact CE3-CG 4.45Å; W440-Q456 HydrophobicContact CH2-CB 3.61Å; W440-Q456 HydrophobicContact CH2-CG 3.96Å; W440-Q456 HydrophobicContact CZ2-CB 3.83Å; W440-Q456 HydrophobicContact CZ2-CG 3.63Å; W440-Q456 HydrophobicContact CZ3-CB 3.63Å; W440-Q456 HydrophobicContact CZ3-CG 4.35Å
441	I	46.9	Very low	40.3	Very low	29 Å²	29	66.8 Å²	66.8	15%	0.149	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	125.4	168.5	-62	177.4	0	0	0	107	L403 L427 V438 S454 F455 L457	L403-I441 HydrophobicContact CD2-CG2 3.3Å; L403-I441 HydrophobicContact CG-CG2 4.39Å; L427-I441 HydrophobicContact CD1-CG2 4.37Å; V438-I441 HydrophobicContact CG1-CG1 4.31Å; I441-S454 CarbonylContact O-C 3.48Å; I441-S454 WeakPolarHBondContact O-CA 3.48Å; I441-F455 HydrophobicContact CB-CB 4.35Å; I441-F455 HydrophobicContact CB-CD2 4.24Å; I441-F455 HydrophobicContact CG2-CD2 4.22Å; I441-F455 PolarHBondContact N-O 3.12Å; I441-F455 PolarHBondContact O-N 3.17Å; I441-L457 HydrophobicContact CD1-CD1 4.04Å; I441-L457 HydrophobicContact CD1-CD2 4.1Å; I441-L457 HydrophobicContact CD1-CG 4.29Å; I441-L457 HydrophobicContact CG1-CD1 4.08Å; I441-L457 HydrophobicContact CG1-CG 4.33Å
442	H	43.5	Very low	40.7	Very low	40 Å²	40	64 Å²	64	19%	0.185	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	128	-179.6	-61.9	-77.6	0	0	0	110.5	L403 D404 T451 A453 S454	L403-H442 CarbonylContact C-O 3.42Å; L403-H442 WeakPolarHBondContact CA-O 3.33Å; D404-H442 PolarHBondContact N-O 3.09Å; D404-H442 PolarHBondContact O-N 3.21Å; D404-H442 VanDerWaalsContact O-N 3.08Å; D404-H442 VanDerWaalsContact O-O 3.1Å; H442-T451 HydrophobicContact CB-CG2 4.16Å; H442-A453 CarbonylContact C-O 3.51Å; H442-A453 WeakPolarHBondContact CA-O 3.29Å; H442-S454 PolarHBondContact CE1-OG 2.86Å; H442-S454 PolarHBondContact ND1-OG 2.65Å
443	L	43.9	Very low	41.1	Very low	27 Å²	27	61.7 Å²	61.7	14%	0.141	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	115.2	160	-81.3	153.8	0	0	0	106.8	I401 K402 L403 T451 L452 A453 F455	I401-L443 HydrophobicContact CG2-CB 4.25Å; I401-L443 HydrophobicContact CG2-CD2 3.32Å; I401-L443 HydrophobicContact CG2-CG 4.34Å; K402-L443 CarbonylContact O-C 3.44Å; K402-L443 VanDerWaalsContact O-CA 3.31Å; K402-L443 WeakPolarHBondContact O-CA 3.12Å; L403-L443 HydrophobicContact CB-CD2 4.21Å; L403-L443 HydrophobicContact CD1-CD2 3.44Å; L403-L443 VanDerWaalsContact CD1-CD2 3.44Å; L403-L443 HydrophobicContact CD1-CG 3.87Å; L403-L443 HydrophobicContact CG-CD2 3.73Å; L403-L443 HydrophobicContact CG-CG 3.93Å; L443-T451 CarbonylContact O-C 3.54Å; L443-T451 WeakPolarHBondContact O-CA 3.12Å; L443-T451 WeakPolarHBondContact O-CG2 3.28Å; L443-L452 HydrophobicContact CB-CB 4.22Å; L443-L452 PolarHBondContact O-N 2.85Å; L443-A453 HydrophobicContact CB-CB 4.08Å; L443-A453 HydrophobicContact CD1-CB 3.74Å; L443-A453 PolarHBondContact N-O 3.15Å; L443-A453 PolarHBondContact O-N 3.08Å; L443-F455 HydrophobicContact CD1-CE2 3.33Å; L443-F455 HydrophobicContact CD1-CZ 3.53Å; L443-F455 HydrophobicContact CG-CE2 4.02Å
444	Y	39.2	Very low	41.3	Very low	61 Å²	61	61.4 Å²	61.4	24%	0.239	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	139.8	-177.4	179.1	-97.3	0	0	0	110	K402 D404 P446 A449 A450	K402-Y444 CarbonylContact C-O 3.52Å; K402-Y444 VanDerWaalsContact C-O 3.25Å; K402-Y444 WeakPolarHBondContact CA-O 3.46Å; K402-Y444 HydrophobicContact CB-CD1 4.26Å; K402-Y444 WeakPolarHBondContact CB-O 3.26Å; K402-Y444 HydrophobicContact CD-CD1 3.5Å; K402-Y444 HydrophobicContact CD-CE1 4.18Å; K402-Y444 HydrophobicContact CD-CG 4.45Å; K402-Y444 PolarHBondContact N-O 3.38Å; K402-Y444 PolarHBondContact O-N 3.2Å; D404-Y444 VanDerWaalsContact OD2-CB 3.25Å; D404-Y444 WeakPolarHBondContact OD2-CB 3.32Å; D404-Y444 VanDerWaalsContact OD2-CG 3.27Å; Y444-P446 HydrophobicContact CD1-CB 4.35Å; Y444-P446 HydrophobicContact CE1-CB 4.12Å; Y444-A449 VanDerWaalsContact OH-CA 3.32Å; Y444-A449 WeakPolarHBondContact OH-CA 3.33Å; Y444-A450 CarbonylContact C-O 3.38Å; Y444-A450 WeakPolarHBondContact CA-O 3.32Å
445	D	40.3	Very low	41.5	Very low	16 Å²	16	60.8 Å²	60.8	9%	0.086	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	114.3	167.9	-172.5	-25.9	0	0	0	108.2	R447 A448 A449 A450 L452	D445-R447 VanDerWaalsContact C-N 3.26Å; D445-R447 PolarHBondContact O-N 2.89Å; D445-R447 WeakPolarHBondContact OD1-CA 3.36Å; D445-R447 VanDerWaalsContact OD1-CB 3.23Å; D445-R447 WeakPolarHBondContact OD1-CB 3.48Å; D445-R447 PolarHBondContact OD1-N 3.08Å; D445-A448 HydrophobicContact CB-CB 3.89Å; D445-A448 PolarHBondContact O-N 3.22Å; D445-A448 PolarHBondContact OD1-N 3.49Å; D445-A448 VanDerWaalsContact OD1-N 3.12Å; D445-A449 WeakPolarHBondContact O-CA 3.32Å; D445-A449 PolarHBondContact O-N 3.43Å; D445-A450 PolarHBondContact N-O 2.85Å; D445-A450 PolarHBondContact O-N 2.74Å; D445-L452 HydrophobicContact CB-CD1 3.65Å; D445-L452 HydrophobicContact CB-CD2 4.06Å; D445-L452 HydrophobicContact CB-CG 3.78Å
446	P	34.3	Very low	41.6	Very low	59 Å²	59	65 Å²	65	38%	0.383	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.9	-17.6	179.1	21.7	-9.2	0	0	0	112.9	K400 K402 Y444	K400-P446 HydrophobicContact CB-CG 4.47Å; K400-P446 WeakPolarHBondContact O-CD 3.25Å; K402-P446 HydrophobicContact CB-CG 3.89Å; K402-P446 HydrophobicContact CD-CB 3.93Å; K402-P446 HydrophobicContact CD-CG 3.84Å; K402-P446 HydrophobicContact CG-CG 3.99Å; Y444-P446 HydrophobicContact CD1-CB 4.35Å; Y444-P446 HydrophobicContact CE1-CB 4.12Å
447	R	34.6	Very low	42	Very low	117 Å²	117	63.7 Å²	63.7	44%	0.442	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.2	-40.4	174.3	-63.6	177	161.3	167.3	-2.9	110.8	E398 K400 D445	E398-R447 VanDerWaalsContact CB-NH1 3.3Å; E398-R447 PolarHBondContact O-NH1 3.04Å; E398-R447 IonicContact OE2-CZ 3.41Å; E398-R447 IonicContact OE2-NH1 3.03Å; E398-R447 PolarHBondContact OE2-NH1 3.14Å; E398-R447 IonicContact OE2-NH2 2.77Å; E398-R447 PolarHBondContact OE2-NH2 2.76Å; K400-R447 HydrophobicContact CB-CG 4.1Å; K400-R447 HydrophobicContact CD-CG 3.96Å; K400-R447 VanDerWaalsContact CD-NE 3.26Å; K400-R447 VanDerWaalsContact CE-NH2 3.31Å; K400-R447 HydrophobicContact CG-CG 4.37Å; K400-R447 VanDerWaalsContact CG-CZ 3.48Å; D445-R447 VanDerWaalsContact C-N 3.26Å; D445-R447 PolarHBondContact O-N 2.89Å; D445-R447 WeakPolarHBondContact OD1-CA 3.36Å; D445-R447 VanDerWaalsContact OD1-CB 3.23Å; D445-R447 WeakPolarHBondContact OD1-CB 3.48Å; D445-R447 PolarHBondContact OD1-N 3.08Å
448	A	43.3	Very low	41.7	Very low	62 Å²	62	66.7 Å²	66.7	51%	0.512	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.5	-6.6	178.7	0	0	0	0	0	113.6	D445 A450	D445-A448 HydrophobicContact CB-CB 3.89Å; D445-A448 PolarHBondContact O-N 3.22Å; D445-A448 PolarHBondContact OD1-N 3.49Å; D445-A448 VanDerWaalsContact OD1-N 3.12Å; A448-A450 HydrophobicContact CB-CB 4.04Å; A448-A450 PolarHBondContact O-N 2.89Å
449	A	43.2	Very low	41.3	Very low	71 Å²	71	72.2 Å²	72.2	59%	0.587	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.8	35.5	-171.4	0	0	0	0	0	113	Y444 D445	Y444-A449 VanDerWaalsContact OH-CA 3.32Å; Y444-A449 WeakPolarHBondContact OH-CA 3.33Å; D445-A449 WeakPolarHBondContact O-CA 3.32Å; D445-A449 PolarHBondContact O-N 3.43Å
450	A	40.3	Very low	40.5	Very low	41 Å²	41	71.3 Å²	71.3	34%	0.339	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	148.1	-167.8	0	0	0	0	0	111.6	Y444 D445 A448	Y444-A450 CarbonylContact C-O 3.38Å; Y444-A450 WeakPolarHBondContact CA-O 3.32Å; D445-A450 PolarHBondContact N-O 2.85Å; D445-A450 PolarHBondContact O-N 2.74Å; A448-A450 HydrophobicContact CB-CB 4.04Å; A448-A450 PolarHBondContact O-N 2.89Å
451	T	43.1	Very low	39.8	Very low	77 Å²	77	70.2 Å²	70.2	47%	0.472	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	118.8	172	-58.8	0	0	0	0	109.6	H442 L443 A453 S454	H442-T451 HydrophobicContact CB-CG2 4.16Å; L443-T451 CarbonylContact O-C 3.54Å; L443-T451 WeakPolarHBondContact O-CA 3.12Å; L443-T451 WeakPolarHBondContact O-CG2 3.28Å; T451-A453 WeakPolarHBondContact CG2-O 3.48Å; T451-S454 WeakPolarHBondContact CG2-OG 3.35Å
452	L	41.1	Very low	39	Very low	83 Å²	83	77.6 Å²	77.6	44%	0.435	47%	0.465	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	-35.3	179.1	-66.3	170.4	0	0	0	112.7	I401 L443 D445	I401-L452 HydrophobicContact CB-CD1 3.7Å; I401-L452 HydrophobicContact CD1-CD1 3.92Å; I401-L452 HydrophobicContact CG1-CD1 3.43Å; I401-L452 VanDerWaalsContact CG1-CD1 3.43Å; I401-L452 HydrophobicContact CG2-CD1 3.47Å; I401-L452 VanDerWaalsContact CG2-CD1 3.47Å; L443-L452 HydrophobicContact CB-CB 4.22Å; L443-L452 PolarHBondContact O-N 2.85Å; D445-L452 HydrophobicContact CB-CD1 3.65Å; D445-L452 HydrophobicContact CB-CD2 4.06Å; D445-L452 HydrophobicContact CB-CG 3.78Å
453	A	41.2	Very low	38.4	Very low	35 Å²	35	81.2 Å²	81.2	29%	0.289	49%	0.485	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.6	155.9	174.4	0	0	0	0	0	110.9	H442 L443 T451 F455	H442-A453 CarbonylContact C-O 3.51Å; H442-A453 WeakPolarHBondContact CA-O 3.29Å; L443-A453 HydrophobicContact CB-CB 4.08Å; L443-A453 HydrophobicContact CD1-CB 3.74Å; L443-A453 PolarHBondContact N-O 3.15Å; L443-A453 PolarHBondContact O-N 3.08Å; T451-A453 WeakPolarHBondContact CG2-O 3.48Å; A453-F455 HydrophobicContact CB-CZ 4.31Å
454	S	40.2	Very low	37.5	Very low	53 Å²	53	85.3 Å²	85.3	37%	0.371	51%	0.514	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	129.2	176.4	-59.8	0	0	0	0	109	I441 H442 T451	I441-S454 CarbonylContact O-C 3.48Å; I441-S454 WeakPolarHBondContact O-CA 3.48Å; H442-S454 PolarHBondContact CE1-OG 2.86Å; H442-S454 PolarHBondContact ND1-OG 2.65Å; T451-S454 WeakPolarHBondContact CG2-OG 3.35Å
455	F	42.8	Very low	36.8	Very low	101 Å²	101	87.9 Å²	87.9	44%	0.443	54%	0.539	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	118.2	177.7	-50.7	-81	0	0	0	108.7	W440 I441 L443 A453 L457	W440-F455 CarbonylContact C-O 3.49Å; W440-F455 VanDerWaalsContact CA-O 3.26Å; W440-F455 WeakPolarHBondContact CA-O 3.23Å; I441-F455 HydrophobicContact CB-CB 4.35Å; I441-F455 HydrophobicContact CB-CD2 4.24Å; I441-F455 HydrophobicContact CG2-CD2 4.22Å; I441-F455 PolarHBondContact N-O 3.12Å; I441-F455 PolarHBondContact O-N 3.17Å; L443-F455 HydrophobicContact CD1-CE2 3.33Å; L443-F455 HydrophobicContact CD1-CZ 3.53Å; L443-F455 HydrophobicContact CG-CE2 4.02Å; A453-F455 HydrophobicContact CB-CZ 4.31Å; F455-L457 PolarHBondContact O-N 3.4Å
456	Q	43.8	Very low	36	Very low	133 Å²	133	94.5 Å²	94.5	62%	0.621	57%	0.574	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-77.7	121.8	170.7	-165.2	172.7	4.9	0	0	108.7	K439 W440 S458	K439-Q456 WeakPolarHBondContact O-CA 3.01Å; W440-Q456 HydrophobicContact CD2-CB 4.13Å; W440-Q456 HydrophobicContact CD2-CG 4.19Å; W440-Q456 HydrophobicContact CE3-CB 3.89Å; W440-Q456 HydrophobicContact CE3-CG 4.45Å; W440-Q456 HydrophobicContact CH2-CB 3.61Å; W440-Q456 HydrophobicContact CH2-CG 3.96Å; W440-Q456 HydrophobicContact CZ2-CB 3.83Å; W440-Q456 HydrophobicContact CZ2-CG 3.63Å; W440-Q456 HydrophobicContact CZ3-CB 3.63Å; W440-Q456 HydrophobicContact CZ3-CG 4.35Å; Q456-S458 PolarHBondContact O-N 2.93Å
457	L	43.6	Very low	35.5	Very low	49 Å²	49	102.6 Å²	102.6	26%	0.257	61%	0.614	S	S	.	*			trans	-79.8	110.8	167.2	-63.7	178.4	0	0	0	106.9	V438 K439 I441 F455 N459 L463	V438-L457 HydrophobicContact CB-CD1 3.99Å; V438-L457 HydrophobicContact CG1-CD1 3.75Å; V438-L457 VanDerWaalsContact O-CD1 3.32Å; V438-L457 WeakPolarHBondContact O-CD1 3.47Å; K439-L457 PolarHBondContact O-N 3.15Å; I441-L457 HydrophobicContact CD1-CD1 4.04Å; I441-L457 HydrophobicContact CD1-CD2 4.1Å; I441-L457 HydrophobicContact CD1-CG 4.29Å; I441-L457 HydrophobicContact CG1-CD1 4.08Å; I441-L457 HydrophobicContact CG1-CG 4.33Å; F455-L457 PolarHBondContact O-N 3.4Å; L457-N459 PolarHBondContact O-N 3.17Å; L457-L463 HydrophobicContact CD1-CD1 4.48Å
458	S	36.7	Very low	35.5	Very low	111 Å²	111	101.9 Å²	101.9	78%	0.776	62%	0.623	S	S	*	*			trans	-65.1	117.1	177.4	48	0	0	0	0	109.3	Q456 A460	Q456-S458 PolarHBondContact O-N 2.93Å; S458-A460 PolarHBondContact O-N 3.46Å; S458-A460 VanDerWaalsContact O-N 3.09Å
459	N	35.2	Very low	35.1	Very low	132 Å²	132	103.9 Å²	103.9	71%	0.706	63%	0.628	S	S	*	*			trans	-46.4	114.4	170.2	-78.1	-19.6	0	0	0	110.5	L457	L457-N459 PolarHBondContact O-N 3.17Å
460	A	28.8	Very low	34.7	Very low	96 Å²	96	105.8 Å²	105.8	79%	0.793	63%	0.631	S	S	*	*	S	Bend	trans	161.4	116.6	135.9	0	0	0	0	0	110.2	S458 E462	S458-A460 PolarHBondContact O-N 3.46Å; S458-A460 VanDerWaalsContact O-N 3.09Å; A460-E462 PolarHBondContact O-N 2.84Å
461	G	30.7	Very low	34.4	Very low	81 Å²	81	109.6 Å²	109.6	84%	0.835	65%	0.648	S	S	*	*	S	Bend	trans	105.4	-54.5	142	0	0	0	0	0	118.4
462	E	30.3	Very low	33.8	Very low	184 Å²	184	111.6 Å²	111.6	86%	0.86	66%	0.659	S	S	*	*			trans	-150.7	78.2	-157.4	-64.6	179.4	175.8	0	0	113.1	A460	A460-E462 PolarHBondContact O-N 2.84Å
463	L	30.2	Very low	33.3	Very low	116 Å²	116	113.5 Å²	113.5	61%	0.607	67%	0.674	S	S	*	*			trans	-97.1	113	149.5	-87	162.1	0	0	0	105.9	L457 C465	L457-L463 HydrophobicContact CD1-CD1 4.48Å; L463-C465 PolarHBondContact O-N 3.22Å
464	P	25.3	Very low	32.8	Very low	113 Å²	113	119.1 Å²	119.1	73%	0.734	70%	0.701	S	S	*	*			trans	-60.2	126.5	-177.4	23.6	-31.2	0	0	0	108.8	L466	P464-L466 PolarHBondContact O-N 3.11Å; P464-L466 VanDerWaalsContact O-N 3.12Å
465	C	24.3	Very low	32.2	Very low	115 Å²	115	124.2 Å²	124.2	78%	0.777	73%	0.727	S	S	*	*			trans	-54.3	119.6	164.8	-62	0	0	0	0	107.7	L463 N467	L463-C465 PolarHBondContact O-N 3.22Å; C465-N467 PolarHBondContact O-N 3.31Å; C465-N467 VanDerWaalsContact O-N 3.15Å
466	L	22.7	Very low	31.3	Very low	155 Å²	155	126.2 Å²	126.2	81%	0.812	75%	0.75	S	S	*	*			trans	-71	100.3	162.1	-77.1	162.7	0	0	0	105.9	P464	P464-L466 PolarHBondContact O-N 3.11Å; P464-L466 VanDerWaalsContact O-N 3.12Å
467	N	24.1	Very low	30.2	Very low	229 Å²	229	125.5 Å²	125.5	100%	1.225	76%	0.762	S	S	*	*			trans	-72.1	0	166.4	-90.1	-6.1	0	0	0	110.7	C465	C465-N467 PolarHBondContact O-N 3.31Å; C465-N467 VanDerWaalsContact O-N 3.15Å

Retrieved 467 of 467 residues in 410.6 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).